Chondroitin sulfate
(2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-sulfooxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C13H21NO15S |
|---|---|
| Molecular Weight | 463.37 g/mol |
| LogP | -4.8 |
| Topological Polar Surface Area | 267.0 A2 |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.0632 |
| Heavy Atoms | 30 |
| Complexity | 739.0 |
Chemical Identifiers
| CAS Number | 9007-28-7 |
|---|---|
| SMILES | CC(=O)NC1C(C(C(OC1O)OS(=O)(=O)O)O)OC2C(C(C(C(O2)C(=O)O)O)O)O |
| InChIKey | KXKPYJOVDUMHGS-OSRGNVMNSA-N |
📖 Product Overview
Chondroitin sulfate (CAS: 9007-28-7) is a chemical compound with molecular formula C13H21NO15S and molecular weight 463.37 g/mol. Its IUPAC systematic name is (2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-sulfooxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
KXKPYJOVDUMHGS-OSRGNVMNSA-N.
SMILES: CC(=O)NC1C(C(C(OC1O)OS(=O)(=O)O)O)OC2C(C(C(C(O2)C(=O)O)O)O)O.
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