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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2017-03-23 05:15:14 UTC

Update Date

2022-03-07 03:17:57 UTC

HMDB ID

HMDB0062643

Secondary Accession Numbers

HMDB62643

Metabolite Identification

Common Name

5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)

Description

[(3,4-dihydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}oxolan-2-yl)methoxy]phosphonic acid belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups. [(3,4-dihydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}oxolan-2-yl)methoxy]phosphonic acid is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

HMDB0062643
     RDKit          3D
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)
 35 35  0  0  0  0  0  0  0  0999 V2000
   -3.5041    1.8632   -1.2475 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4705    1.7788    0.2665 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.0634    2.6674    0.7716 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8056    2.3524    1.0077 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0686    0.1910    0.7994 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1208   -0.5948   -0.4046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7199   -0.9852   -0.7546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9277    0.1741   -0.5383 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2287   -0.2328    0.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0791   -0.6632   -0.9624 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7015   -0.4674   -0.6483 P   0  0  0  0  0  5  0  0  0  0  0  0
    2.8756   -0.1846    0.8379 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5055   -1.9398   -1.0297 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4550    0.7224   -1.5752 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5846    1.5005   -0.5499 P   0  0  0  0  0  5  0  0  0  0  0  0
    5.8187    1.9151   -1.2706 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7507    2.8216    0.1184 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0100    0.4120    0.6686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2289   -1.4773    0.8851 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0326   -1.0350    1.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0587   -2.1396   -0.1848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8727   -3.1501    0.2558 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2628    3.5628    1.0654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7094    3.3019    1.3387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8246   -0.3683   -1.1143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5377   -1.6118    0.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6890   -1.0823   -1.9161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6716    0.4762    0.7629 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2366   -2.5477   -0.2811 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3772    3.3174   -0.6668 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5214   -0.3276    0.2401 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6346   -2.0869    1.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8017   -0.1449    2.1966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3153   -2.6161   -0.9256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4368   -3.4012   -0.5525 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 15 18  1  0
  9 19  1  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 21  7  1  0
  3 23  1  0
  4 24  1  0
  6 25  1  0
  6 26  1  0
  7 27  1  0
  9 28  1  0
 13 29  1  0
 17 30  1  0
 18 31  1  0
 19 32  1  0
 20 33  1  0
 21 34  1  0
 22 35  1  0
M  END


  Mrv1652305161822332D          

 22 22  0  0  0  0            999 V2000
    0.5678    1.1143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5678    1.9393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2352    0.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0198    0.8843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9803   -0.1553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4652   -0.8227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2857   -0.7365    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.3719   -1.5569    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1061   -0.6502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5911   -1.3177    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    4.0760   -1.9851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1553   -0.1553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0997    0.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8843    0.8843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0558    1.6913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8405    1.9462    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6251    2.2012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1994    0.0840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2585   -0.8327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9236   -1.8026    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5855    2.7308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0954    1.1616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 13  1  1  0  0  0  0
 18  7  1  0  0  0  0
 19 10  1  0  0  0  0
 20 10  1  0  0  0  0
 21 16  1  0  0  0  0
 22 16  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0062643

> <DATABASE_NAME>
hmdb

> <SMILES>
OC1C(O)C(OP(O)(=O)OP(O)(O)=O)OC1COP(O)(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C5H13O14P3/c6-3-2(1-16-20(8,9)10)17-5(4(3)7)18-22(14,15)19-21(11,12)13/h2-7H,1H2,(H,14,15)(H2,8,9,10)(H2,11,12,13)

> <INCHI_KEY>
PQGCEDQWHSBAJP-UHFFFAOYSA-N

> <FORMULA>
C5H13O14P3

> <MOLECULAR_WEIGHT>
390.066

> <EXACT_MASS>
389.951816093

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_ATOM_COUNT>
35

> <JCHEM_AVERAGE_POLARIZABILITY>
27.331004321348235

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[({3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}oxy)(hydroxy)phosphoryl]oxy}phosphonic acid

> <ALOGPS_LOGP>
-0.74

> <JCHEM_LOGP>
-2.971134817666666

> <ALOGPS_LOGS>
-1.53

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-4

> <JCHEM_PKA>
1.7946491011714985

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.0892767445547742

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6809081734732274

> <JCHEM_POLAR_SURFACE_AREA>
229.73999999999995

> <JCHEM_REFRACTIVITY>
62.579600000000006

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.16e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
({3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}oxy(hydroxy)phosphoryl)oxyphosphonic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0062643
     RDKit          3D
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)
 35 35  0  0  0  0  0  0  0  0999 V2000
   -3.5041    1.8632   -1.2475 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4705    1.7788    0.2665 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.0634    2.6674    0.7716 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8056    2.3524    1.0077 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0686    0.1910    0.7994 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1208   -0.5948   -0.4046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7199   -0.9852   -0.7546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9277    0.1741   -0.5383 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2287   -0.2328    0.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0791   -0.6632   -0.9624 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7015   -0.4674   -0.6483 P   0  0  0  0  0  5  0  0  0  0  0  0
    2.8756   -0.1846    0.8379 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5055   -1.9398   -1.0297 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4550    0.7224   -1.5752 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5846    1.5005   -0.5499 P   0  0  0  0  0  5  0  0  0  0  0  0
    5.8187    1.9151   -1.2706 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7507    2.8216    0.1184 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0100    0.4120    0.6686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2289   -1.4773    0.8851 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0326   -1.0350    1.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0587   -2.1396   -0.1848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8727   -3.1501    0.2558 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2628    3.5628    1.0654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7094    3.3019    1.3387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8246   -0.3683   -1.1143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5377   -1.6118    0.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6890   -1.0823   -1.9161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6716    0.4762    0.7629 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2366   -2.5477   -0.2811 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3772    3.3174   -0.6668 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5214   -0.3276    0.2401 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6346   -2.0869    1.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8017   -0.1449    2.1966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3153   -2.6161   -0.9256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4368   -3.4012   -0.5525 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 15 18  1  0
  9 19  1  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 21  7  1  0
  3 23  1  0
  4 24  1  0
  6 25  1  0
  6 26  1  0
  7 27  1  0
  9 28  1  0
 13 29  1  0
 17 30  1  0
 18 31  1  0
 19 32  1  0
 20 33  1  0
 21 34  1  0
 22 35  1  0
M  END

HEADER    PROTEIN                                 16-MAY-18   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   16-MAY-18         0                                  
HETATM    1  C   UNK     0       1.060   2.080   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       1.060   3.620   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       2.306   1.175   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       3.770   1.651   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       1.830  -0.290   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       2.735  -1.536   0.000  0.00  0.00           O+0
HETATM    7  P   UNK     0       4.267  -1.375   0.000  0.00  0.00           P+0
HETATM    8  O   UNK     0       4.428  -2.906   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0       5.798  -1.214   0.000  0.00  0.00           O+0
HETATM   10  P   UNK     0       6.703  -2.460   0.000  0.00  0.00           P+0
HETATM   11  O   UNK     0       7.609  -3.706   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0       0.290  -0.290   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      -0.186   1.175   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -1.651   1.651   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      -1.971   3.157   0.000  0.00  0.00           O+0
HETATM   16  P   UNK     0      -3.436   3.633   0.000  0.00  0.00           P+0
HETATM   17  O   UNK     0      -4.900   4.109   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       4.106   0.157   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       7.949  -1.554   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0       5.457  -3.365   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      -2.960   5.098   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      -3.911   2.168   0.000  0.00  0.00           O+0
CONECT    1    2    3   13                                                  
CONECT    2    1                                                            
CONECT    3    1    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6   12                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8    9   18                                             
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11   19   20                                             
CONECT   11   10                                                            
CONECT   12    5   13                                                       
CONECT   13   12   14    1                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17   21   22                                             
CONECT   17   16                                                            
CONECT   18    7                                                            
CONECT   19   10                                                            
CONECT   20   10                                                            
CONECT   21   16                                                            
CONECT   22   16                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   44    0
END

COMPND    HMDB0062643
HETATM    1  O1  UNL     1      -3.504   1.863  -1.247  1.00  0.00           O  
HETATM    2  P1  UNL     1      -3.470   1.779   0.267  1.00  0.00           P  
HETATM    3  O2  UNL     1      -2.063   2.667   0.772  1.00  0.00           O  
HETATM    4  O3  UNL     1      -4.806   2.352   1.008  1.00  0.00           O  
HETATM    5  O4  UNL     1      -3.069   0.191   0.799  1.00  0.00           O  
HETATM    6  C1  UNL     1      -3.121  -0.595  -0.405  1.00  0.00           C  
HETATM    7  C2  UNL     1      -1.720  -0.985  -0.755  1.00  0.00           C  
HETATM    8  O5  UNL     1      -0.928   0.174  -0.538  1.00  0.00           O  
HETATM    9  C3  UNL     1       0.229  -0.233   0.062  1.00  0.00           C  
HETATM   10  O6  UNL     1       1.079  -0.663  -0.962  1.00  0.00           O  
HETATM   11  P2  UNL     1       2.701  -0.467  -0.648  1.00  0.00           P  
HETATM   12  O7  UNL     1       2.876  -0.185   0.838  1.00  0.00           O  
HETATM   13  O8  UNL     1       3.505  -1.940  -1.030  1.00  0.00           O  
HETATM   14  O9  UNL     1       3.455   0.722  -1.575  1.00  0.00           O  
HETATM   15  P3  UNL     1       4.585   1.501  -0.550  1.00  0.00           P  
HETATM   16  O10 UNL     1       5.819   1.915  -1.271  1.00  0.00           O  
HETATM   17  O11 UNL     1       3.751   2.822   0.118  1.00  0.00           O  
HETATM   18  O12 UNL     1       5.010   0.412   0.669  1.00  0.00           O  
HETATM   19  C4  UNL     1      -0.229  -1.477   0.885  1.00  0.00           C  
HETATM   20  O13 UNL     1      -1.033  -1.035   1.885  1.00  0.00           O  
HETATM   21  C5  UNL     1      -1.059  -2.140  -0.185  1.00  0.00           C  
HETATM   22  O14 UNL     1      -1.873  -3.150   0.256  1.00  0.00           O  
HETATM   23  H1  UNL     1      -2.263   3.563   1.065  1.00  0.00           H  
HETATM   24  H2  UNL     1      -4.709   3.302   1.339  1.00  0.00           H  
HETATM   25  H3  UNL     1      -3.825  -0.368  -1.114  1.00  0.00           H  
HETATM   26  H4  UNL     1      -3.538  -1.612   0.112  1.00  0.00           H  
HETATM   27  H5  UNL     1      -1.689  -1.082  -1.916  1.00  0.00           H  
HETATM   28  H6  UNL     1       0.672   0.476   0.763  1.00  0.00           H  
HETATM   29  H7  UNL     1       3.237  -2.548  -0.281  1.00  0.00           H  
HETATM   30  H8  UNL     1       3.377   3.317  -0.667  1.00  0.00           H  
HETATM   31  H9  UNL     1       5.521  -0.328   0.240  1.00  0.00           H  
HETATM   32  H10 UNL     1       0.635  -2.087   1.186  1.00  0.00           H  
HETATM   33  H11 UNL     1      -0.802  -0.145   2.197  1.00  0.00           H  
HETATM   34  H12 UNL     1      -0.315  -2.616  -0.926  1.00  0.00           H  
HETATM   35  H13 UNL     1      -2.437  -3.401  -0.552  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4    5
CONECT    3   23
CONECT    4   24
CONECT    5    6
CONECT    6    7   25   26
CONECT    7    8   21   27
CONECT    8    9
CONECT    9   10   19   28
CONECT   10   11
CONECT   11   12   12   13   14
CONECT   13   29
CONECT   14   15
CONECT   15   16   16   17   18
CONECT   17   30
CONECT   18   31
CONECT   19   20   21   32
CONECT   20   33
CONECT   21   22   34
CONECT   22   35
END

HMDB0062643
     RDKit          3D
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)
 35 35  0  0  0  0  0  0  0  0999 V2000
   -3.5041    1.8632   -1.2475 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4705    1.7788    0.2665 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.0634    2.6674    0.7716 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8056    2.3524    1.0077 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0686    0.1910    0.7994 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1208   -0.5948   -0.4046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7199   -0.9852   -0.7546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9277    0.1741   -0.5383 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2287   -0.2328    0.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0791   -0.6632   -0.9624 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7015   -0.4674   -0.6483 P   0  0  0  0  0  5  0  0  0  0  0  0
    2.8756   -0.1846    0.8379 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5055   -1.9398   -1.0297 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4550    0.7224   -1.5752 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5846    1.5005   -0.5499 P   0  0  0  0  0  5  0  0  0  0  0  0
    5.8187    1.9151   -1.2706 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7507    2.8216    0.1184 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0100    0.4120    0.6686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2289   -1.4773    0.8851 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0326   -1.0350    1.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0587   -2.1396   -0.1848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8727   -3.1501    0.2558 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2628    3.5628    1.0654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7094    3.3019    1.3387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8246   -0.3683   -1.1143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5377   -1.6118    0.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6890   -1.0823   -1.9161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6716    0.4762    0.7629 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2366   -2.5477   -0.2811 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3772    3.3174   -0.6668 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5214   -0.3276    0.2401 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6346   -2.0869    1.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8017   -0.1449    2.1966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3153   -2.6161   -0.9256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4368   -3.4012   -0.5525 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 15 18  1  0
  9 19  1  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 21  7  1  0
  3 23  1  0
  4 24  1  0
  6 25  1  0
  6 26  1  0
  7 27  1  0
  9 28  1  0
 13 29  1  0
 17 30  1  0
 18 31  1  0
 19 32  1  0
 20 33  1  0
 21 34  1  0
 22 35  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
[(3,4-Dihydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}oxolan-2-yl)methoxy]phosphonate	Generator
5-O-Phosphonato-a-D-ribofuranosyl diphosphate(5-)	Generator
5-O-Phosphonato-a-D-ribofuranosyl diphosphoric acid(5-)	Generator
5-O-Phosphonato-alpha-D-ribofuranosyl diphosphoric acid(5-)	Generator
5-O-Phosphonato-α-D-ribofuranosyl diphosphate(5-)	Generator
5-O-Phosphonato-α-D-ribofuranosyl diphosphoric acid(5-)	Generator
5-O-Phosphonato-a-D-ribofuranosyl diphosphate pentaanion	HMDB
5-O-Phosphonato-a-D-ribofuranosyl diphosphoric acid pentaanion	HMDB
5-O-Phosphonato-alpha-D-ribofuranosyl diphosphate pentaanion	HMDB
5-O-Phosphonato-alpha-D-ribofuranosyl diphosphoric acid pentaanion	HMDB
5-O-Phosphonato-α-D-ribofuranosyl diphosphate pentaanion	HMDB
5-O-Phosphonato-α-D-ribofuranosyl diphosphoric acid pentaanion	HMDB
5-Phospho-a-D-ribose 1-diphosphate	HMDB
5-Phospho-a-D-ribose 1-diphosphoric acid	HMDB
5-Phospho-alpha-D-ribose 1-diphosphate	HMDB
5-Phospho-alpha-D-ribose 1-diphosphoric acid	HMDB
5-Phospho-α-D-ribose 1-diphosphate	HMDB
5-Phospho-α-D-ribose 1-diphosphoric acid	HMDB
5-Phosphonatoribosyl 1-pyrophosphate	HMDB
5-Phosphonatoribosyl 1-pyrophosphoric acid	HMDB
5-Phosphoribosyl 1-pyrophosphate	HMDB
5-Phosphoribosyl 1-pyrophosphoric acid	HMDB

Chemical Formula

C₅H₁₃O₁₄P₃

Average Molecular Weight

390.066

Monoisotopic Molecular Weight

389.951816093

IUPAC Name

{[({3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}oxy)(hydroxy)phosphoryl]oxy}phosphonic acid

Traditional Name

({3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}oxy(hydroxy)phosphoryl)oxyphosphonic acid

CAS Registry Number

Not Available

SMILES

OC1C(O)C(OP(O)(=O)OP(O)(O)=O)OC1COP(O)(O)=O

InChI Identifier

InChI=1S/C5H13O14P3/c6-3-2(1-16-20(8,9)10)17-5(4(3)7)18-22(14,15)19-21(11,12)13/h2-7H,1H2,(H,14,15)(H2,8,9,10)(H2,11,12,13)

InChI Key

PQGCEDQWHSBAJP-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Pentose phosphates

Alternative Parents

Substituents

Pentose phosphate
Pentose-5-phosphate
Monosaccharide phosphate
Organic pyrophosphate
Monoalkyl phosphate
Organic phosphoric acid derivative
Phosphoric acid ester
Alkyl phosphate
Tetrahydrofuran
1,2-diol
Secondary alcohol
Organoheterocyclic compound
Oxacycle
Alcohol
Hydrocarbon derivative
Organic oxide
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Not Available

Not Available

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	58.2 g/l	ALOGPS
LogP	-0.78	ALOGPS

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
logP	-0.74	ALOGPS
logP	-3	ChemAxon
logS	-1.5	ALOGPS
pKa (Strongest Acidic)	1.09	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	-4	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	229.74 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	62.58 m³·mol⁻¹	ChemAxon
Polarizability	27.33 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	131.334	30932474
DeepCCS	[M-H]-	128.965	30932474
DeepCCS	[M-2H]-	162.286	30932474
DeepCCS	[M+Na]+	137.36	30932474
AllCCS	[M+H]+	177.2	32859911
AllCCS	[M+H-H2O]+	174.5	32859911
AllCCS	[M+NH4]+	179.6	32859911
AllCCS	[M+Na]+	180.3	32859911
AllCCS	[M-H]-	165.1	32859911
AllCCS	[M+Na-2H]-	165.2	32859911
AllCCS	[M+HCOO]-	165.5	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)	OC1C(O)C(OP(O)(=O)OP(O)(O)=O)OC1COP(O)(O)=O	3763.9	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)	OC1C(O)C(OP(O)(=O)OP(O)(O)=O)OC1COP(O)(O)=O	2452.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-)	OC1C(O)C(OP(O)(=O)OP(O)(O)=O)OC1COP(O)(O)=O	3226.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O)C1O	3110.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TMS,isomer #2	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O)O)C1O	3120.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TMS,isomer #3	C[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O)O	3119.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TMS,isomer #4	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O)O)C(O)C1O	3120.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O	3205.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	3066.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #10	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O)OC1OC(COP(=O)(O)O)C(O)C1O	3077.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #11	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C(O)C1O	3155.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #12	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C	3124.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	3106.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	3042.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	3056.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #5	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O)C1O	3057.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #6	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	3067.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #7	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3114.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #8	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C(O)C1O	3125.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TMS,isomer #9	C[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)O[Si](C)(C)C	3076.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	2978.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	2956.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	4322.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #10	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3000.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #10	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3057.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #10	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C)C1O	4224.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	2958.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	3083.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	4224.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #12	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3007.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #12	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3064.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #12	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	4253.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #13	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3008.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #13	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3019.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #13	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	4223.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #14	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C	3030.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #14	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C	3123.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #14	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C	4100.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #15	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C(O)C1O	3033.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #15	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C(O)C1O	3153.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #15	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C(O)C1O	4135.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #16	C[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2977.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #16	C[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3170.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #16	C[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	4105.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	3033.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	3151.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	4102.6	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	3038.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	3126.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	4126.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	2950.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	2993.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	4325.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	2947.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3003.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	4357.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	3005.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	3024.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	4206.9	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	2990.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	3061.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	4215.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	3004.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	3067.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	4242.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	2956.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	3098.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	4243.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2950.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3093.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	4215.6	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #9	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	2971.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #9	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	3086.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TMS,isomer #9	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	4250.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	2932.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	3003.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C	3995.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #10	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2900.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #10	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3152.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #10	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3876.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	2914.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	3135.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O)C1O	3882.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #12	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	2951.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #12	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3133.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #12	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3936.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #13	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2959.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #13	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3098.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #13	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3930.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #14	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	2957.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #14	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3121.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #14	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3904.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #15	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2963.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #15	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3102.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #15	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3961.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #16	C[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	2974.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #16	C[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3179.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #16	C[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3855.6	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	2974.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	3180.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	3806.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #18	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	2984.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #18	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3174.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #18	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3822.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	2918.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	3038.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	3980.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	2916.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3048.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	4017.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	2888.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3080.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3982.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	2879.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3073.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3955.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	2952.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	3108.7	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O	3916.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	2957.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	3112.7	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O	3947.6	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	2940.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	3139.7	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	3928.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #9	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2949.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #9	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3128.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TMS,isomer #9	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3895.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	2934.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	3054.8	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C	3706.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #10	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2970.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #10	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3140.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #10	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3669.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2969.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3134.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #11	C[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3638.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #12	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	2968.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #12	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3191.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #12	C[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	3539.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	2941.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3058.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3748.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	2931.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3085.8	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3700.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	2932.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3080.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3672.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	2899.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3102.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #5	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3625.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	2965.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	3151.8	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #6	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O	3657.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2965.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3147.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #7	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3625.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2958.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3155.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #8	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3599.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #9	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	2969.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #9	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3146.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),5TMS,isomer #9	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C)C1O	3605.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	2924.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3073.7	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O)O[Si](C)(C)C)C1O[Si](C)(C)C	3461.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	2924.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3064.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #2	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3436.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	2917.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3081.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #3	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3395.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2954.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3137.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #4	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3363.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #5	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	2967.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #5	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3127.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),6TMS,isomer #5	C[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O	3372.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),7TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	2926.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),7TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3060.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),7TMS,isomer #1	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C1O[Si](C)(C)C	3215.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O)C1O	3345.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O)O)C1O	3354.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O)O	3373.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O)O)C(O)C1O	3371.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O	3419.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3436.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OC1OC(COP(=O)(O)O)C(O)C1O	3506.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(O)C1O	3550.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C(C)(C)C	3549.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	3509.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	3457.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3473.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O)C1O	3469.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3482.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3518.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C(O)C1O	3540.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)O[Si](C)(C)C(C)(C)C	3506.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3579.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3473.8	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	4481.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3600.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3572.7	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4402.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3584.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3572.7	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	4390.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3608.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3596.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4413.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3615.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3512.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	4437.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C(C)(C)C	3632.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C(C)(C)C	3610.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C(O)C1O)O[Si](C)(C)C(C)(C)C	4335.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(O)C1O	3620.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(O)C1O	3687.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(O)C1O	4303.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3611.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3654.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(OC1OC(COP(=O)(O)O)C(O)C1O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	4281.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	3620.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	3647.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	4291.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	3628.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	3628.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(O)OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	4344.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3538.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3504.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	4481.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3554.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3531.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4494.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	3613.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	3524.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O	4421.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	3593.3	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	3582.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	4393.5	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3598.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3604.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4403.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3572.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3625.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4395.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3574.7	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3590.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	4382.9	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3580.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3608.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	4402.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3719.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3600.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	4249.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3672.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3753.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	4060.4	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3684.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	3743.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O)C1O	4065.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3712.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3771.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4117.2	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3731.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3694.2	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	4163.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3713.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3730.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4103.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3734.2	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3711.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1C(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	4188.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	3738.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	3781.6	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OP(=O)(O)OP(=O)(OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4075.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	3731.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	3790.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OCC1OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O	4001.6	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	3741.8	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	3743.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(O)C1O)O[Si](C)(C)C(C)(C)C	4060.7	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3699.6	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	3653.3	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O[Si](C)(C)C(C)(C)C	4185.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3699.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3677.0	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4213.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3667.9	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3709.5	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4163.8	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3669.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3677.4	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4153.3	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	3726.4	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	3701.8	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O)C1O	4150.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3727.1	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3716.8	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4175.1	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3702.5	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	3771.1	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C1O	4110.0	Standard polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3702.0	Semi standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	3731.9	Standard non polar	33892256
5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-),4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(OP(=O)(O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C1O	4095.5	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 10V, Positive-QTOF	splash10-004i-3923000000-0aeb4691f17d9c6586d8	2019-02-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 20V, Positive-QTOF	splash10-0002-9372000000-0adc07dca4fd93a592a3	2019-02-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 40V, Positive-QTOF	splash10-002b-9810000000-9e218271dbdb2fdf925d	2019-02-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 10V, Negative-QTOF	splash10-000i-0409000000-0cc90aea90be9d3e3692	2019-02-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 20V, Negative-QTOF	splash10-01t9-9100000000-faaa47ee9ca6058fabea	2019-02-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 40V, Negative-QTOF	splash10-004i-9000000000-99f74d45d3681b71d3b3	2019-02-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 10V, Positive-QTOF	splash10-0006-0139000000-0fbee2c4dd4960710d64	2021-09-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 20V, Positive-QTOF	splash10-03dl-1495000000-9a8036b31361904588ff	2021-09-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 40V, Positive-QTOF	splash10-01oy-2940000000-dec891cae4d11ef7fde5	2021-09-21	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 10V, Negative-QTOF	splash10-000i-0009000000-8bba058b3002916747ff	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 20V, Negative-QTOF	splash10-0a4i-1900000000-fe5c4990d029bfb534dc	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) 40V, Negative-QTOF	splash10-0a6r-6900000000-e70675e444d4c8790d6f	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

1041

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Not Available

Showing metabocard for 5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-) (HMDB0062643)

MOL for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

3D MOL for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

3D SDF for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

3D-SDF for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

PDB for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

3D PDB for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

SMILES for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

INCHI for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

Structure for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

3D Structure for HMDB0062643 (5-O-phosphonato-alpha-D-ribofuranosyl Diphosphate(5-))

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra