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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2013-05-17 01:22:00 UTC
Update Date2022-03-07 03:17:45 UTC
HMDB IDHMDB0060454
Secondary Accession Numbers
  • HMDB60454
Metabolite Identification
Common NameChondroitin D-glucuronate
DescriptionChondroitin D-glucuronate belongs to the class of organic compounds known as n-acyl-alpha-hexosamines. These are carbohydrate derivatives containing a hexose moiety in which the oxygen atom is replaced by an n-acyl group. Chondroitin D-glucuronate is a moderately basic compound (based on its pKa).
Structure
Data?1563866062
Synonyms
ValueSource
Chondroitin D-glucuronic acidGenerator
Chemical FormulaC16H27NO11
Average Molecular Weight409.3857
Monoisotopic Molecular Weight409.158410711
IUPAC Name(2S,3S,4S,5R,6R)-4,5-dihydroxy-6-{[(2R,3R,4R,5R,6R)-3-hydroxy-5-[(1-hydroxyethylidene)amino]-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy}-3-methyloxane-2-carboxylic acid
Traditional Name(2S,3S,4S,5R,6R)-4,5-dihydroxy-6-{[(2R,3R,4R,5R,6R)-3-hydroxy-5-[(1-hydroxyethylidene)amino]-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy}-3-methyloxane-2-carboxylic acid
CAS Registry NumberNot Available
SMILES
CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](C)[C@H](O)[C@H]2O)C(O)=O)[C@H]1N=C(C)O
InChI Identifier
InChI=1S/C16H27NO11/c1-5-9(20)11(22)16(27-12(5)14(23)24)28-13-8(17-6(2)19)15(25-3)26-7(4-18)10(13)21/h5,7-13,15-16,18,20-22H,4H2,1-3H3,(H,17,19)(H,23,24)/t5-,7+,8+,9-,10-,11+,12-,13+,15+,16-/m0/s1
InChI KeyCQQZQIXOOJJXET-KWXMYFLUSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as n-acyl-alpha-hexosamines. These are carbohydrate derivatives containing a hexose moiety in which the oxygen atom is replaced by an n-acyl group.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassCarbohydrates and carbohydrate conjugates
Direct ParentN-acyl-alpha-hexosamines
Alternative Parents
Substituents
  • N-acyl-alpha-hexosamine
  • Glucuronic acid or derivatives
  • Glycosyl compound
  • O-glycosyl compound
  • Monosaccharide
  • Oxane
  • Pyran
  • Secondary alcohol
  • Acetal
  • Carboximidic acid
  • Carboximidic acid derivative
  • Carboxylic acid derivative
  • Carboxylic acid
  • Monocarboxylic acid or derivatives
  • Oxacycle
  • Organoheterocyclic compound
  • Organic 1,3-dipolar compound
  • Propargyl-type 1,3-dipolar organic compound
  • Organic oxide
  • Hydrocarbon derivative
  • Carbonyl group
  • Organonitrogen compound
  • Alcohol
  • Primary alcohol
  • Organic nitrogen compound
  • Organopnictogen compound
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Not AvailableNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility54.8 g/LALOGPS
logP-2ALOGPS
logP-2.2ChemAxon
logS-0.87ALOGPS
pKa (Strongest Acidic)3.23ChemAxon
pKa (Strongest Basic)1.37ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count12ChemAxon
Hydrogen Donor Count6ChemAxon
Polar Surface Area187.73 ŲChemAxon
Rotatable Bond Count6ChemAxon
Refractivity87.9 m³·mol⁻¹ChemAxon
Polarizability38.99 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+193.48731661259
DarkChem[M-H]-184.41631661259
DeepCCS[M+H]+192.74630932474
DeepCCS[M-H]-190.91430932474
DeepCCS[M-2H]-224.45830932474
DeepCCS[M+Na]+198.35230932474
AllCCS[M+H]+192.332859911
AllCCS[M+H-H2O]+189.932859911
AllCCS[M+NH4]+194.532859911
AllCCS[M+Na]+195.132859911
AllCCS[M-H]-192.532859911
AllCCS[M+Na-2H]-192.932859911
AllCCS[M+HCOO]-193.432859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Chondroitin D-glucuronateCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](C)[C@H](O)[C@H]2O)C(O)=O)[C@H]1N=C(C)O4270.6Standard polar33892256
Chondroitin D-glucuronateCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](C)[C@H](O)[C@H]2O)C(O)=O)[C@H]1N=C(C)O3040.5Standard non polar33892256
Chondroitin D-glucuronateCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](C)[C@H](O)[C@H]2O)C(O)=O)[C@H]1N=C(C)O3057.2Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Chondroitin D-glucuronate,1TMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2847.5Semi standard non polar33892256
Chondroitin D-glucuronate,1TMS,isomer #2CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2844.6Semi standard non polar33892256
Chondroitin D-glucuronate,1TMS,isomer #3CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2850.7Semi standard non polar33892256
Chondroitin D-glucuronate,1TMS,isomer #4CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2845.5Semi standard non polar33892256
Chondroitin D-glucuronate,1TMS,isomer #5CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2836.7Semi standard non polar33892256
Chondroitin D-glucuronate,1TMS,isomer #6CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2909.0Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2799.9Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #10CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2791.7Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #11CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2804.8Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #12CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2850.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #13CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2798.4Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #14CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2857.3Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #15CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2816.6Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2795.8Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2815.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2814.3Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2841.6Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #6CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2777.0Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #7CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2802.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #8CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2796.0Semi standard non polar33892256
Chondroitin D-glucuronate,2TMS,isomer #9CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2821.8Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O2761.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #10CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2795.5Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #11CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2782.4Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #12CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2768.0Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #13CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2733.9Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #14CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2771.9Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #15CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2782.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #16CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2765.2Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #17CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2787.4Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #18CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2787.1Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #19CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2785.0Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2802.0Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #20CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2780.4Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2786.1Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2760.1Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2806.7Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #6CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2801.9Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #7CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2768.7Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #8CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2795.2Semi standard non polar33892256
Chondroitin D-glucuronate,3TMS,isomer #9CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2799.7Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O2789.2Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #10CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2746.0Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #11CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2755.1Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #12CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2746.4Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #13CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2724.5Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #14CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2723.7Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #15CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2744.4Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2778.0Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2729.2Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2778.8Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2756.1Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #6CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2732.2Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #7CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2782.5Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #8CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2769.6Semi standard non polar33892256
Chondroitin D-glucuronate,4TMS,isomer #9CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2757.4Semi standard non polar33892256
Chondroitin D-glucuronate,5TMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O2769.9Semi standard non polar33892256
Chondroitin D-glucuronate,5TMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C2763.5Semi standard non polar33892256
Chondroitin D-glucuronate,5TMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2743.7Semi standard non polar33892256
Chondroitin D-glucuronate,5TMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2740.4Semi standard non polar33892256
Chondroitin D-glucuronate,5TMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2746.7Semi standard non polar33892256
Chondroitin D-glucuronate,5TMS,isomer #6CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2721.2Semi standard non polar33892256
Chondroitin D-glucuronate,6TMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C2762.0Semi standard non polar33892256
Chondroitin D-glucuronate,1TBDMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3051.4Semi standard non polar33892256
Chondroitin D-glucuronate,1TBDMS,isomer #2CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3023.9Semi standard non polar33892256
Chondroitin D-glucuronate,1TBDMS,isomer #3CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3048.5Semi standard non polar33892256
Chondroitin D-glucuronate,1TBDMS,isomer #4CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3041.2Semi standard non polar33892256
Chondroitin D-glucuronate,1TBDMS,isomer #5CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3056.5Semi standard non polar33892256
Chondroitin D-glucuronate,1TBDMS,isomer #6CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3119.7Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3192.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #10CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3214.2Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #11CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3214.2Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #12CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3284.6Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #13CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3222.3Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #14CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3288.0Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #15CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3260.7Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3202.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3215.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3212.8Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3257.2Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #6CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3187.5Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #7CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3205.1Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #8CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3198.7Semi standard non polar33892256
Chondroitin D-glucuronate,2TBDMS,isomer #9CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3240.7Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O3378.2Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #10CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3439.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #11CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3390.7Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #12CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3389.4Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #13CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3392.9Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #14CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3385.9Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #15CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3428.0Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #16CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3419.9Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #17CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3404.2Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #18CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3442.8Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #19CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3441.7Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3397.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #20CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3450.8Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3396.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3397.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3404.3Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #6CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3409.4Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #7CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3421.8Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #8CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3393.1Semi standard non polar33892256
Chondroitin D-glucuronate,3TBDMS,isomer #9CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3444.6Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #1CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O3572.0Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #10CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3600.9Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #11CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3543.5Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #12CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3562.9Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #13CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3571.1Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #14CO[C@@H]1O[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3569.2Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #15CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3581.8Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #2CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3572.0Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #3CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3561.7Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #4CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3577.1Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #5CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3590.2Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #6CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3588.6Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #7CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O3582.4Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #8CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3600.0Semi standard non polar33892256
Chondroitin D-glucuronate,4TBDMS,isomer #9CO[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H]1N=C(C)O[Si](C)(C)C(C)(C)C3613.3Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Chondroitin D-glucuronate GC-MS (Non-derivatized) - 70eV, Positivesplash10-004u-8429000000-ad4d2bd75ae186c566ba2017-09-20Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Chondroitin D-glucuronate GC-MS (4 TMS) - 70eV, Positivesplash10-001i-4901037000-953face800f0f03f7f5f2017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Chondroitin D-glucuronate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Chondroitin D-glucuronate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 10V, Positive-QTOFsplash10-00ko-0189200000-d267a593cc56460184d72017-10-06Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 20V, Positive-QTOFsplash10-014u-0393000000-0cfb6145407f92ebb0f22017-10-06Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 40V, Positive-QTOFsplash10-014u-5490000000-7885ed8627c9099e1d112017-10-06Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 10V, Negative-QTOFsplash10-052o-4429400000-125de07b11a07e8ca83f2017-10-06Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 20V, Negative-QTOFsplash10-0016-9667000000-7bafd2ce33639cd6ac0e2017-10-06Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 40V, Negative-QTOFsplash10-0a4i-9200000000-32715dfd75a3905864872017-10-06Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 10V, Positive-QTOFsplash10-03di-0003900000-60dcb11a680da889d5e02021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 20V, Positive-QTOFsplash10-0cg3-1965200000-3adfd54b21d28ae6ca4b2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 40V, Positive-QTOFsplash10-0mvi-9431000000-10e383835c0c8a51bf562021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 10V, Negative-QTOFsplash10-0a4i-0005900000-dde59d7e6e6fd5ca99d72021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 20V, Negative-QTOFsplash10-0a4i-4419300000-f56aefa299fba11127382021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Chondroitin D-glucuronate 40V, Negative-QTOFsplash10-0006-9211000000-005d84f99563f16b55982021-10-12Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDNot Available
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound131769912
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Magrane M: UniProt Knowledgebase: a hub of integrated protein data. Database (Oxford). 2011 Mar 29;2011:bar009. doi: 10.1093/database/bar009. Print 2011. [PubMed:21447597 ]

Enzymes

General function:
Involved in chondroitin-glucuronate 5-epimerase activity
Specific function:
Converts D-glucuronic acid to L-iduronic acid (IdoUA) residues.
Gene Name:
DSE
Uniprot ID:
Q9UL01
Molecular weight:
109772.235
Reactions
Chondroitin D-glucuronate → dermatan L-iduronatedetails