硫酸软骨素三糖
TL;DR: 硫酸软骨素三糖 (CAS 92848-50-5) is a chemical compound with molecular formula C22H36N2O23S2 and molecular weight 760.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸软骨素三糖
(2S,3S,4R,5R,6R)-6-[(2R,3R,4S,5R)-2-acetamido-4,5-dihydroxy-1-oxo-6-sulfooxyhexan-3-yl]oxy-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(sulfooxymethyl)oxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid
Also Known As: Chondroitin sulfate trisaccharide, (2S,3S,4R,5R,6R)-6-[(2R,3R,4S,5R)-2-acetamido-4,5-dihydroxy-1-oxo-6-sulfooxyhexan-3-yl]oxy-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(sulfooxymethyl)oxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid, N-Acetylgalactosamine 6-sulfate-glucuronic acid-N-acetylgalactosamine 6-sulfate, D-Galactose, O-2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-galactopyranosyl-(1-4)-O-beta-D-glucopyranuronosyl-(1-3)-2-(acetylamino)-2-deoxy-, 6-(hydrogen sulfate), 2-(acetylamino)-2-deoxy-6-o-sulfo-
| Molecular Formula | C22H36N2O23S2 |
|---|---|
| Molecular Weight | 760.12 g/mol |
| LogP | -8.2 |
| Topological Polar Surface Area | 415.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 17 |
| Exact Mass | 760.11505 |
| Heavy Atoms | 49 |
| Complexity | 1370.0 |
Chemical Identifiers
| CAS Number | 92848-50-5 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2C(=O)O)O[C@H]([C@H](C=O)NC(=O)C)[C@H]([C@@H](COS(=O)(=O)O)O)O)O)O)COS(=O)(=O)O)O)O |
| InChIKey | JWWBQNVBYSWTKC-AZQDBXNISA-N |
Product Overview
硫酸软骨素三糖 (CAS 92848-50-5), with molecular formula C22H36N2O23S2 and molecular weight 760.12 g/mol. IUPAC: (2S,3S,4R,5R,6R)-6-[(2R,3R,4S,5R)-2-acetamido-4,5-dihydroxy-1-oxo-6-sulfooxyhexan-3-yl]oxy-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(sulfooxymethyl)oxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of 硫酸软骨素三糖
Property Insights of 硫酸软骨素三糖
The XLogP value of -8.2 indicates that 硫酸软骨素三糖 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 415.0 Ų indicates high polarity, suggesting 硫酸软骨素三糖 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸软骨素三糖 has 11 hydrogen bond donor(s) and 23 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫酸软骨素三糖?
The CAS number of 硫酸软骨素三糖 is 92848-50-5.
What is the molecular formula of 硫酸软骨素三糖?
The molecular formula of 硫酸软骨素三糖 is C22H36N2O23S2.
What is the molecular weight of 硫酸软骨素三糖?
The molecular weight of 硫酸软骨素三糖 is 760.12 g/mol.
Where can I buy 硫酸软骨素三糖?
You can request a quote for 硫酸软骨素三糖 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸软骨素三糖?
Yes, KEHONG BIO provides custom synthesis services for 硫酸软骨素三糖 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.