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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (5) Show 5 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-06 15:16:49 UTC

Update Date

2022-03-07 02:51:35 UTC

HMDB ID

HMDB0014347

Secondary Accession Numbers

HMDB14347

Metabolite Identification

Common Name

Succinylcholine

Description

Succinylcholine, also known as suxamethonium or scoline, belongs to the class of organic compounds known as acyl cholines. These are acylated derivatives of choline. Choline or 2-Hydroxy-N,N,N-trimethylethanaminium is a quaternary ammonium salt with the chemical formula (CH3)3N+(CH2)2OH. A quaternary ammonium ion that is the bis-choline ester of succinic acid. Succinylcholine is a drug which is used in surgical procedures where a rapid onset and brief duration of muscle relaxation is needed (includes intubation, endoscopies, and ect). Succinylcholine is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

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

HMDB0014347
     RDKit          3D
Succinylcholine
 50 49  0  0  0  0  0  0  0  0999 V2000
    5.0871   -1.6724   -0.6256 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3957   -0.4221    0.0111 N   0  0  0  0  0  4  0  0  0  0  0  0
    5.2360    0.6277   -0.9784 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8170   -0.4524    0.3478 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6692   -0.1616    1.2022 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1972   -0.4804    1.1106 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6698    0.3402    0.0588 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3485    0.3158   -0.3086 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5842   -0.4654    0.3149 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7653    1.1453   -1.3868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6960    0.9280   -1.5720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4914    1.2436   -0.3649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9228    1.6567    0.6771 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8539    1.1014   -0.3329 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6673    1.3815    0.7744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1075    1.0907    0.3891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2974   -0.2806    0.0083 N   0  0  0  0  0  4  0  0  0  0  0  0
   -5.1000   -1.1977    1.1027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6894   -0.4099   -0.4270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4662   -0.6910   -1.0821 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8065   -1.7859   -1.4785 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2714   -2.5482    0.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790   -1.6820   -1.0891 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0949    1.6223   -0.5287 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1471    0.6179   -1.6121 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3339    0.4241   -1.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9053   -1.0664    1.2737 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1335    0.5933    0.6263 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4363   -0.8791   -0.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8339    0.8974    1.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0668   -0.7631    2.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9830   -1.5270    0.9246 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6506   -0.1662    2.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9423    2.2279   -1.2521 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2769    0.8571   -2.3278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0257    1.5301   -2.4416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9040   -0.1426   -1.8153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3744    0.8996    1.7044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5946    2.4875    0.9504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4381    1.7343   -0.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7781    1.3262    1.2403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7952   -2.0505    0.9612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3643   -0.7162    2.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0718   -1.6300    1.1173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1911   -1.2691    0.0804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2847    0.4823   -0.1714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7709   -0.5548   -1.5145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0192   -1.5171   -1.6159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3425    0.1058   -1.8347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4851   -1.1050   -0.7758 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 17 20  1  0
  1 21  1  0
  1 22  1  0
  1 23  1  0
  3 24  1  0
  3 25  1  0
  3 26  1  0
  4 27  1  0
  4 28  1  0
  4 29  1  0
  5 30  1  0
  5 31  1  0
  6 32  1  0
  6 33  1  0
 10 34  1  0
 10 35  1  0
 11 36  1  0
 11 37  1  0
 15 38  1  0
 15 39  1  0
 16 40  1  0
 16 41  1  0
 18 42  1  0
 18 43  1  0
 18 44  1  0
 19 45  1  0
 19 46  1  0
 19 47  1  0
 20 48  1  0
 20 49  1  0
 20 50  1  0
M  CHG  2   2   1  17   1
M  END

202
  Mrv0541 02231214312D          

 20 19  0  0  0  0            999 V2000
    4.5077    0.2063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0799   -0.2063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2221   -1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3655    1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3644   -0.2063    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   10.2233    0.2063    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0789    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5088   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7768   -0.9206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9519    0.5082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6499   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6358   -0.5082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8108    0.9206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9376    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7933   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7944    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9366    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6511   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2221   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3655    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  1 19  1  0  0  0  0
  2 16  1  0  0  0  0
  2 20  1  0  0  0  0
  3 19  2  0  0  0  0
  4 20  2  0  0  0  0
  5  7  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  2   5   1   6   1
M  END
> <DATABASE_ID>
HMDB0014347

> <DATABASE_NAME>
hmdb

> <SMILES>
C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C14H30N2O4/c1-15(2,3)9-11-19-13(17)7-8-14(18)20-12-10-16(4,5)6/h7-12H2,1-6H3/q+2

> <INCHI_KEY>
AXOIZCJOOAYSMI-UHFFFAOYSA-N

> <FORMULA>
C14H30N2O4

> <MOLECULAR_WEIGHT>
290.399

> <EXACT_MASS>
290.220557458

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_AVERAGE_POLARIZABILITY>
33.154778734073865

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
2

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
trimethyl[2-({4-oxo-4-[2-(trimethylazaniumyl)ethoxy]butanoyl}oxy)ethyl]azanium

> <ALOGPS_LOGP>
-2.49

> <JCHEM_LOGP>
-8.394079043610159

> <ALOGPS_LOGS>
-5.68

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA_STRONGEST_BASIC>
-6.751914352242649

> <JCHEM_POLAR_SURFACE_AREA>
52.6

> <JCHEM_REFRACTIVITY>
100.94059999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.57e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
succinylcholine

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0014347
     RDKit          3D
Succinylcholine
 50 49  0  0  0  0  0  0  0  0999 V2000
    5.0871   -1.6724   -0.6256 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3957   -0.4221    0.0111 N   0  0  0  0  0  4  0  0  0  0  0  0
    5.2360    0.6277   -0.9784 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8170   -0.4524    0.3478 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6692   -0.1616    1.2022 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1972   -0.4804    1.1106 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6698    0.3402    0.0588 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3485    0.3158   -0.3086 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5842   -0.4654    0.3149 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7653    1.1453   -1.3868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6960    0.9280   -1.5720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4914    1.2436   -0.3649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9228    1.6567    0.6771 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8539    1.1014   -0.3329 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6673    1.3815    0.7744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1075    1.0907    0.3891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2974   -0.2806    0.0083 N   0  0  0  0  0  4  0  0  0  0  0  0
   -5.1000   -1.1977    1.1027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6894   -0.4099   -0.4270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4662   -0.6910   -1.0821 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8065   -1.7859   -1.4785 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2714   -2.5482    0.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790   -1.6820   -1.0891 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0949    1.6223   -0.5287 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1471    0.6179   -1.6121 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3339    0.4241   -1.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9053   -1.0664    1.2737 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1335    0.5933    0.6263 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4363   -0.8791   -0.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8339    0.8974    1.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0668   -0.7631    2.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9830   -1.5270    0.9246 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6506   -0.1662    2.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9423    2.2279   -1.2521 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2769    0.8571   -2.3278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0257    1.5301   -2.4416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9040   -0.1426   -1.8153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3744    0.8996    1.7044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5946    2.4875    0.9504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4381    1.7343   -0.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7781    1.3262    1.2403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7952   -2.0505    0.9612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3643   -0.7162    2.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0718   -1.6300    1.1173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1911   -1.2691    0.0804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2847    0.4823   -0.1714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7709   -0.5548   -1.5145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0192   -1.5171   -1.6159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3425    0.1058   -1.8347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4851   -1.1050   -0.7758 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 17 20  1  0
  1 21  1  0
  1 22  1  0
  1 23  1  0
  3 24  1  0
  3 25  1  0
  3 26  1  0
  4 27  1  0
  4 28  1  0
  4 29  1  0
  5 30  1  0
  5 31  1  0
  6 32  1  0
  6 33  1  0
 10 34  1  0
 10 35  1  0
 11 36  1  0
 11 37  1  0
 15 38  1  0
 15 39  1  0
 16 40  1  0
 16 41  1  0
 18 42  1  0
 18 43  1  0
 18 44  1  0
 19 45  1  0
 19 46  1  0
 19 47  1  0
 20 48  1  0
 20 49  1  0
 20 50  1  0
M  CHG  2   2   1  17   1
M  END

HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 202                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  O   UNK     0       8.414   0.385   0.000  0.00  0.00           O+0
HETATM    2  O   UNK     0      15.082  -0.385   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0       9.748  -1.925   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      13.749   1.925   0.000  0.00  0.00           O+0
HETATM    5  N   UNK     0       4.414  -0.385   0.000  0.00  0.00           N+1
HETATM    6  N   UNK     0      19.083   0.385   0.000  0.00  0.00           N+1
HETATM    7  C   UNK     0       5.747   0.385   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      17.750  -0.385   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       5.183  -1.718   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       3.644   0.949   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       3.080  -1.155   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      19.853  -0.949   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      18.313   1.718   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      20.417   1.155   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       7.081  -0.385   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      16.416   0.385   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      11.082   0.385   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      12.415  -0.385   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       9.748  -0.385   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      13.749   0.385   0.000  0.00  0.00           C+0
CONECT    1   15   19                                                       
CONECT    2   16   20                                                       
CONECT    3   19                                                            
CONECT    4   20                                                            
CONECT    5    7    9   10   11                                             
CONECT    6    8   12   13   14                                             
CONECT    7    5   15                                                       
CONECT    8    6   16                                                       
CONECT    9    5                                                            
CONECT   10    5                                                            
CONECT   11    5                                                            
CONECT   12    6                                                            
CONECT   13    6                                                            
CONECT   14    6                                                            
CONECT   15    1    7                                                       
CONECT   16    2    8                                                       
CONECT   17   18   19                                                       
CONECT   18   17   20                                                       
CONECT   19    1    3   17                                                  
CONECT   20    2    4   18                                                  
MASTER        0    0    0    0    0    0    0    0   20    0   38    0
END

COMPND    HMDB0014347
HETATM    1  C1  UNL     1       5.087  -1.672  -0.626  1.00  0.00           C  
HETATM    2  N1  UNL     1       5.396  -0.422   0.011  1.00  0.00           N1+
HETATM    3  C2  UNL     1       5.236   0.628  -0.978  1.00  0.00           C  
HETATM    4  C3  UNL     1       6.817  -0.452   0.348  1.00  0.00           C  
HETATM    5  C4  UNL     1       4.669  -0.162   1.202  1.00  0.00           C  
HETATM    6  C5  UNL     1       3.197  -0.480   1.111  1.00  0.00           C  
HETATM    7  O1  UNL     1       2.670   0.340   0.059  1.00  0.00           O  
HETATM    8  C6  UNL     1       1.349   0.316  -0.309  1.00  0.00           C  
HETATM    9  O2  UNL     1       0.584  -0.465   0.315  1.00  0.00           O  
HETATM   10  C7  UNL     1       0.765   1.145  -1.387  1.00  0.00           C  
HETATM   11  C8  UNL     1      -0.696   0.928  -1.572  1.00  0.00           C  
HETATM   12  C9  UNL     1      -1.491   1.244  -0.365  1.00  0.00           C  
HETATM   13  O3  UNL     1      -0.923   1.657   0.677  1.00  0.00           O  
HETATM   14  O4  UNL     1      -2.854   1.101  -0.333  1.00  0.00           O  
HETATM   15  C10 UNL     1      -3.667   1.381   0.774  1.00  0.00           C  
HETATM   16  C11 UNL     1      -5.107   1.091   0.389  1.00  0.00           C  
HETATM   17  N2  UNL     1      -5.297  -0.281   0.008  1.00  0.00           N1+
HETATM   18  C12 UNL     1      -5.100  -1.198   1.103  1.00  0.00           C  
HETATM   19  C13 UNL     1      -6.689  -0.410  -0.427  1.00  0.00           C  
HETATM   20  C14 UNL     1      -4.466  -0.691  -1.082  1.00  0.00           C  
HETATM   21  H1  UNL     1       5.807  -1.786  -1.478  1.00  0.00           H  
HETATM   22  H2  UNL     1       5.271  -2.548   0.029  1.00  0.00           H  
HETATM   23  H3  UNL     1       4.079  -1.682  -1.089  1.00  0.00           H  
HETATM   24  H4  UNL     1       5.095   1.622  -0.529  1.00  0.00           H  
HETATM   25  H5  UNL     1       6.147   0.618  -1.612  1.00  0.00           H  
HETATM   26  H6  UNL     1       4.334   0.424  -1.626  1.00  0.00           H  
HETATM   27  H7  UNL     1       6.905  -1.066   1.274  1.00  0.00           H  
HETATM   28  H8  UNL     1       7.134   0.593   0.626  1.00  0.00           H  
HETATM   29  H9  UNL     1       7.436  -0.879  -0.441  1.00  0.00           H  
HETATM   30  H10 UNL     1       4.834   0.897   1.490  1.00  0.00           H  
HETATM   31  H11 UNL     1       5.067  -0.763   2.058  1.00  0.00           H  
HETATM   32  H12 UNL     1       2.983  -1.527   0.925  1.00  0.00           H  
HETATM   33  H13 UNL     1       2.651  -0.166   2.022  1.00  0.00           H  
HETATM   34  H14 UNL     1       0.942   2.228  -1.252  1.00  0.00           H  
HETATM   35  H15 UNL     1       1.277   0.857  -2.328  1.00  0.00           H  
HETATM   36  H16 UNL     1      -1.026   1.530  -2.442  1.00  0.00           H  
HETATM   37  H17 UNL     1      -0.904  -0.143  -1.815  1.00  0.00           H  
HETATM   38  H18 UNL     1      -3.374   0.900   1.704  1.00  0.00           H  
HETATM   39  H19 UNL     1      -3.595   2.488   0.950  1.00  0.00           H  
HETATM   40  H20 UNL     1      -5.438   1.734  -0.450  1.00  0.00           H  
HETATM   41  H21 UNL     1      -5.778   1.326   1.240  1.00  0.00           H  
HETATM   42  H22 UNL     1      -5.795  -2.051   0.961  1.00  0.00           H  
HETATM   43  H23 UNL     1      -5.364  -0.716   2.060  1.00  0.00           H  
HETATM   44  H24 UNL     1      -4.072  -1.630   1.117  1.00  0.00           H  
HETATM   45  H25 UNL     1      -7.191  -1.269   0.080  1.00  0.00           H  
HETATM   46  H26 UNL     1      -7.285   0.482  -0.171  1.00  0.00           H  
HETATM   47  H27 UNL     1      -6.771  -0.555  -1.515  1.00  0.00           H  
HETATM   48  H28 UNL     1      -5.019  -1.517  -1.616  1.00  0.00           H  
HETATM   49  H29 UNL     1      -4.343   0.106  -1.835  1.00  0.00           H  
HETATM   50  H30 UNL     1      -3.485  -1.105  -0.776  1.00  0.00           H  
CONECT    1    2   21   22   23
CONECT    2    3    4    5
CONECT    3   24   25   26
CONECT    4   27   28   29
CONECT    5    6   30   31
CONECT    6    7   32   33
CONECT    7    8
CONECT    8    9    9   10
CONECT   10   11   34   35
CONECT   11   12   36   37
CONECT   12   13   13   14
CONECT   14   15
CONECT   15   16   38   39
CONECT   16   17   40   41
CONECT   17   18   19   20
CONECT   18   42   43   44
CONECT   19   45   46   47
CONECT   20   48   49   50
END

HMDB0014347
     RDKit          3D
Succinylcholine
 50 49  0  0  0  0  0  0  0  0999 V2000
    5.0871   -1.6724   -0.6256 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3957   -0.4221    0.0111 N   0  0  0  0  0  4  0  0  0  0  0  0
    5.2360    0.6277   -0.9784 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8170   -0.4524    0.3478 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6692   -0.1616    1.2022 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1972   -0.4804    1.1106 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6698    0.3402    0.0588 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3485    0.3158   -0.3086 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5842   -0.4654    0.3149 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7653    1.1453   -1.3868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6960    0.9280   -1.5720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4914    1.2436   -0.3649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9228    1.6567    0.6771 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8539    1.1014   -0.3329 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6673    1.3815    0.7744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1075    1.0907    0.3891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2974   -0.2806    0.0083 N   0  0  0  0  0  4  0  0  0  0  0  0
   -5.1000   -1.1977    1.1027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6894   -0.4099   -0.4270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4662   -0.6910   -1.0821 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8065   -1.7859   -1.4785 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2714   -2.5482    0.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790   -1.6820   -1.0891 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0949    1.6223   -0.5287 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1471    0.6179   -1.6121 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3339    0.4241   -1.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9053   -1.0664    1.2737 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1335    0.5933    0.6263 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4363   -0.8791   -0.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8339    0.8974    1.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0668   -0.7631    2.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9830   -1.5270    0.9246 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6506   -0.1662    2.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9423    2.2279   -1.2521 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2769    0.8571   -2.3278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0257    1.5301   -2.4416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9040   -0.1426   -1.8153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3744    0.8996    1.7044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5946    2.4875    0.9504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4381    1.7343   -0.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7781    1.3262    1.2403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7952   -2.0505    0.9612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3643   -0.7162    2.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0718   -1.6300    1.1173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1911   -1.2691    0.0804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2847    0.4823   -0.1714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7709   -0.5548   -1.5145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0192   -1.5171   -1.6159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3425    0.1058   -1.8347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4851   -1.1050   -0.7758 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 17 20  1  0
  1 21  1  0
  1 22  1  0
  1 23  1  0
  3 24  1  0
  3 25  1  0
  3 26  1  0
  4 27  1  0
  4 28  1  0
  4 29  1  0
  5 30  1  0
  5 31  1  0
  6 32  1  0
  6 33  1  0
 10 34  1  0
 10 35  1  0
 11 36  1  0
 11 37  1  0
 15 38  1  0
 15 39  1  0
 16 40  1  0
 16 41  1  0
 18 42  1  0
 18 43  1  0
 18 44  1  0
 19 45  1  0
 19 46  1  0
 19 47  1  0
 20 48  1  0
 20 49  1  0
 20 50  1  0
M  CHG  2   2   1  17   1
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
2,2'-[(1,4-DIOXOBUTANE-1,4-diyl)bis(oxy)]bis(N,N,N-trimethylethanaminium)	ChEBI
Dicholine succinate	ChEBI
Succinic acid, diester with choline	ChEBI
Succinocholine	ChEBI
Succinoylcholine	ChEBI
Succinylbischoline	ChEBI
Succinyldicholine	ChEBI
Suxamethonium	ChEBI
Dicholine succinic acid	Generator
Succinate, diester with choline	Generator
Scoline	HMDB
Succinylcholine chloride	HMDB
Suxamethonium chloride	HMDB
Bromide, suxamethonium	HMDB
Succinylcholine dichloride	HMDB
Succinylcholine dichloride, di H2O	HMDB
Suxamethonium bromide	HMDB
Anectine	HMDB
Dibromide, succinylcholine	HMDB
Diiodide, succinylcholine	HMDB
Diperchlorate, succinylcholine	HMDB
Listenon	HMDB
Succicuran	HMDB
Succinylcholine dibromide	HMDB
Succinylcholine iodide	HMDB
Dichloride, succinylcholine	HMDB
Ditilin	HMDB
Celocurine	HMDB
Lysthenon	HMDB
Myorelaxin	HMDB
Quelicin	HMDB
Succinylcholine dichloride, di-H2O	HMDB
Succinylcholine diiodide	HMDB
Succinylcholine diperchlorate	HMDB
Succinate, dicholine	HMDB

Chemical Formula

C₁₄H₃₀N₂O₄

Average Molecular Weight

290.399

Monoisotopic Molecular Weight

290.220557458

IUPAC Name

trimethyl[2-({4-oxo-4-[2-(trimethylazaniumyl)ethoxy]butanoyl}oxy)ethyl]azanium

Traditional Name

succinylcholine

CAS Registry Number

306-40-1

SMILES

C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C

InChI Identifier

InChI=1S/C14H30N2O4/c1-15(2,3)9-11-19-13(17)7-8-14(18)20-12-10-16(4,5)6/h7-12H2,1-6H3/q+2

InChI Key

AXOIZCJOOAYSMI-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as acyl cholines. These are acylated derivatives of choline. Choline or 2-Hydroxy-N,N,N-trimethylethanaminium is a quaternary ammonium salt with the chemical formula (CH3)3N+(CH2)2OH.

Kingdom

Organic compounds

Super Class

Organic nitrogen compounds

Class

Organonitrogen compounds

Sub Class

Quaternary ammonium salts

Direct Parent

Acyl cholines

Alternative Parents

Substituents

Acyl choline
Fatty acid ester
Dicarboxylic acid or derivatives
Fatty acyl
Tetraalkylammonium salt
Carboxylic acid ester
Carboxylic acid derivative
Organic oxygen compound
Amine
Organooxygen compound
Organic salt
Hydrocarbon derivative
Organic oxide
Organopnictogen compound
Carbonyl group
Organic cation
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

quaternary ammonium ion (CHEBI:45652 )

Ontology

Physiological effect

Not Available

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Blood (PMID: 21059682)

Excreta

Biofluid or Excreta

Urine (PMID: 21059682)

Cellular substructure

Cytoplasm (HMDB: HMDB0014347)
Membrane (HMDB: HMDB0014347)

Source

Exogenous

Exogenous (HMDB: HMDB0014347)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	0.00076 g/L	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.00076 g/L	ALOGPS
logP	-2.5	ALOGPS
logP	-8.4	ChemAxon
logS	-5.7	ALOGPS
pKa (Strongest Basic)	-6.8	ChemAxon
Physiological Charge	2	ChemAxon
Hydrogen Acceptor Count	2	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	52.6 Å²	ChemAxon
Rotatable Bond Count	11	ChemAxon
Refractivity	100.94 m³·mol⁻¹	ChemAxon
Polarizability	33.15 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	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]+	162.333	30932474
DeepCCS	[M-H]-	159.975	30932474
DeepCCS	[M-2H]-	194.075	30932474
DeepCCS	[M+Na]+	169.957	30932474
AllCCS	[M+H]+	175.2	32859911
AllCCS	[M+H-H2O]+	172.7	32859911
AllCCS	[M+NH4]+	177.4	32859911
AllCCS	[M+Na]+	178.1	32859911
AllCCS	[M-H]-	202.0	32859911
AllCCS	[M+Na-2H]-	202.7	32859911
AllCCS	[M+HCOO]-	203.5	32859911

Predicted Retention Times

Underivatized

Chromatographic Method	Retention Time	Reference
Measured using a Waters Acquity ultraperformance liquid chromatography (UPLC) ethylene-bridged hybrid (BEH) C18 column (100 mm × 2.1 mm; 1.7 μmparticle diameter). Predicted by Afia on May 17, 2022. Predicted by Afia on May 17, 2022.	1.8 minutes	32390414
Predicted by Siyang on May 30, 2022	9.5005 minutes	33406817
Predicted by Siyang using ReTip algorithm on June 8, 2022	5.5 minutes	32390414
Fem_Long = Waters ACQUITY UPLC HSS T3 C18 with Water:MeOH and 0.1% Formic Acid	524.9 seconds	40023050
Fem_Lipids = Ascentis Express C18 with (60:40 water:ACN):(90:10 IPA:ACN) and 10mM NH4COOH + 0.1% Formic Acid	191.0 seconds	40023050
Life_Old = Waters ACQUITY UPLC BEH C18 with Water:(20:80 acetone:ACN) and 0.1% Formic Acid	125.3 seconds	40023050
Life_New = RP Waters ACQUITY UPLC HSS T3 C18 with Water:(30:70 MeOH:ACN) and 0.1% Formic Acid	172.5 seconds	40023050
RIKEN = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	57.4 seconds	40023050
Eawag_XBridgeC18 = XBridge C18 3.5u 2.1x50 mm with Water:MeOH and 0.1% Formic Acid	235.6 seconds	40023050
BfG_NTS_RP1 =Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) with Water:ACN and 0.1% Formic Acid	291.9 seconds	40023050
HILIC_BDD_2 = Merck SeQuant ZIC-HILIC with ACN(0.1% formic acid):water(16 mM ammonium formate)	1008.8 seconds	40023050
UniToyama_Atlantis = RP Waters Atlantis T3 (2.1 x 150 mm, 5 um) with ACN:Water and 0.1% Formic Acid	828.4 seconds	40023050
BDD_C18 = Hypersil Gold 1.9µm C18 with Water:ACN and 0.1% Formic Acid	47.1 seconds	40023050
UFZ_Phenomenex = Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex with Water:MeOH and 0.1% Formic Acid	1346.4 seconds	40023050
SNU_RIKEN_POS = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	208.4 seconds	40023050
RPMMFDA = Waters ACQUITY UPLC BEH C18 with Water:ACN and 0.1% Formic Acid	213.7 seconds	40023050
MTBLS87 = Merck SeQuant ZIC-pHILIC column with ACN:Water and :ammonium carbonate	620.1 seconds	40023050
KI_GIAR_zic_HILIC_pH2_7 = Merck SeQuant ZIC-HILIC with ACN:Water and 0.1% FA	548.1 seconds	40023050
Meister zic-pHILIC pH9.3 = Merck SeQuant ZIC-pHILIC column with ACN:Water 5mM NH4Ac pH9.3 and 5mM ammonium acetate in water	87.3 seconds	40023050

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Succinylcholine	C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C	2258.0	Standard polar	33892256
Succinylcholine	C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C	1406.1	Standard non polar	33892256
Succinylcholine	C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C	1858.8	Semi standard non polar	33892256

Spectra

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Membrane

Biospecimen Locations

Blood
Urine

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Taking drug identified by DrugBank entry DB00202	21059682	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Taking drug identified by DrugBank entry DB00202	21059682	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

DB00202

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

5123

KEGG Compound ID

C07546

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Suxamethonium chloride

METLIN ID

Not Available

PubChem Compound

5314

PDB ID

SCK

ChEBI ID

45652

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

Jonsson M, Dabrowski M, Gurley DA, Larsson O, Johnson EC, Fredholm BB, Eriksson LI: Activation and inhibition of human muscular and neuronal nicotinic acetylcholine receptors by succinylcholine. Anesthesiology. 2006 Apr;104(4):724-33. [PubMed:16571968 ]

Enzymes

Enzyme Details

1. Cholinesterase

General function:: Involved in carboxylesterase activity
Specific function:: Esterase with broad substrate specificity. Contributes to the inactivation of the neurotransmitter acetylcholine. Can degrade neurotoxic organophosphate esters.
Gene Name:: BCHE
Uniprot ID:: P06276
Molecular weight:: 68417.575

References

Ostergaard D, Engbaek J, Viby-Mogensen J: Adverse reactions and interactions of the neuromuscular blocking drugs. Med Toxicol Adverse Drug Exp. 1989 Sep-Oct;4(5):351-68. [PubMed:2682131 ]

Enzyme Details

2. Neuronal acetylcholine receptor subunit alpha-10

General function:: Involved in extracellular ligand-gated ion channel activity
Specific function:: Ionotropic receptor with a probable role in the modulation of auditory stimuli. Agonist binding may induce an extensive change in conformation that affects all subunits and leads to opening of an ion-conducting channel across the plasma membrane. The channel is permeable to a range of divalent cations including calcium, the influx of which may activate a potassium current which hyperpolarizes the cell membrane. In the ear, this may lead to a reduction in basilar membrane motion, altering the activity of auditory nerve fibers and reducing the range of dynamic hearing. This may protect against acoustic trauma
Gene Name:: CHRNA10
Uniprot ID:: Q9GZZ6
Molecular weight:: 49704.3

References

Jonsson M, Dabrowski M, Gurley DA, Larsson O, Johnson EC, Fredholm BB, Eriksson LI: Activation and inhibition of human muscular and neuronal nicotinic acetylcholine receptors by succinylcholine. Anesthesiology. 2006 Apr;104(4):724-33. [PubMed:16571968 ]

Enzyme Details

3. Muscarinic acetylcholine receptor M3

General function:: Involved in G-protein coupled receptor protein signaling pathway
Specific function:: The muscarinic acetylcholine receptor mediates various cellular responses, including inhibition of adenylate cyclase, breakdown of phosphoinositides and modulation of potassium channels through the action of G proteins. Primary transducing effect is Pi turnover
Gene Name:: CHRM3
Uniprot ID:: P20309
Molecular weight:: 66127.4

References

Hou VY, Hirshman CA, Emala CW: Neuromuscular relaxants as antagonists for M2 and M3 muscarinic receptors. Anesthesiology. 1998 Mar;88(3):744-50. [PubMed:9523819 ]
Chen X, Ji ZL, Chen YZ: TTD: Therapeutic Target Database. Nucleic Acids Res. 2002 Jan 1;30(1):412-5. [PubMed:11752352 ]

Enzyme Details

4. Muscarinic acetylcholine receptor M1

General function:: Involved in G-protein coupled receptor protein signaling pathway
Specific function:: The muscarinic acetylcholine receptor mediates various cellular responses, including inhibition of adenylate cyclase, breakdown of phosphoinositides and modulation of potassium channels through the action of G proteins. Primary transducing effect is Pi turnover
Gene Name:: CHRM1
Uniprot ID:: P11229
Molecular weight:: 51420.4

References

Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. [PubMed:17139284 ]
Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. [PubMed:17016423 ]
Fisher DM: Clinical pharmacology of neuromuscular blocking agents. Am J Health Syst Pharm. 1999 Jun 1;56(11 Suppl 1):S4-9. [PubMed:10437710 ]

Enzyme Details

5. Muscarinic acetylcholine receptor M2

General function:: Involved in G-protein coupled receptor protein signaling pathway
Specific function:: The muscarinic acetylcholine receptor mediates various cellular responses, including inhibition of adenylate cyclase, breakdown of phosphoinositides and modulation of potassium channels through the action of G proteins. Primary transducing effect is adenylate cyclase inhibition
Gene Name:: CHRM2
Uniprot ID:: P08172
Molecular weight:: 51714.6

References

Hou VY, Hirshman CA, Emala CW: Neuromuscular relaxants as antagonists for M2 and M3 muscarinic receptors. Anesthesiology. 1998 Mar;88(3):744-50. [PubMed:9523819 ]

Showing metabocard for Succinylcholine (HMDB0014347)

MOL for HMDB0014347 (Succinylcholine)

3D MOL for HMDB0014347 (Succinylcholine)

3D SDF for HMDB0014347 (Succinylcholine)

3D-SDF for HMDB0014347 (Succinylcholine)

PDB for HMDB0014347 (Succinylcholine)

3D PDB for HMDB0014347 (Succinylcholine)

SMILES for HMDB0014347 (Succinylcholine)

INCHI for HMDB0014347 (Succinylcholine)

Structure for HMDB0014347 (Succinylcholine)

3D Structure for HMDB0014347 (Succinylcholine)

Predicted Collision Cross Sections

Predicted Retention Times

Underivatized

Predicted Kovats Retention Indices

Underivatized

NMR Spectra

Enzymes

References

References

References

References

References