Chondroitin Sulphate
6-(3-acetamido-2,5-dihydroxy-6-sulfooxyoxan-4-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Identity
Chondroitin Sulphate
6-(3-acetamido-2,5-dihydroxy-6-sulfooxyoxan-4-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
PubChem CID: 21873177
2D Structure
Properties
C13H21NO15S
Molecular Formula
463.37
Molecular Weight
g/mol
463.0632
Exact Mass
Da
-4.8
XLogP
Drug-like (Lipinski: < 5)
267
TPSA
May have limited oral absorption
8
H-Bond Donors
15
H-Bond Acceptors
739
Complexity
SMILES
Canonical SMILES
SMILES: CC(=O)NC1C(C(C(OC1O)OS(=O)(=O)O)O)OC2C(C(C(C(O2)C(=O)O)O)O)OIsomeric SMILES
SMILES: CC(=O)NC1C(C(C(OC1O)OS(=O)(=O)O)O)OC2C(C(C(C(O2)C(=O)O)O)O)OSynonyms(17)
Chondroitin sulphateRefChem:576093609-686-1C13H21NO15SChondroitin sulfate sodium salt from shark cartilageorb1304776(2S,3S,4S,5R,6R)-6-[[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-sulfooxy-4-oxanyl]oxy]-3,4,5-trihydroxy-2-oxanecarboxylic acids2416s9004AKOS040750265NCGC00181291-01LS-14244OC138665ChondroitinsulfatesodiumsaltfromsharkcartilageT2980
Data from PubChem (NCBI)
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Trials and conditions connected to Chondroitin Sulphate
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