2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose
TL;DR: 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose (CAS 52259-40-2) is a chemical compound with molecular formula C14H23NO15S and molecular weight 477.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-6-[(3R,4R,5R,6R)-3-acetamido-2-hydroxy-6-(hydroxymethyl)-5-sulfooxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: GlcA(b1-3)GalNAc4S, GlyTouCan:G92988PL, 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose, (2S,3S,4S,5R,6R)-6-[(3R,4R,5R,6R)-3-Acetamido-2-hydroxy-6-(hydroxymethyl)-5-sulfooxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid, beta-D-gluco-hexopyranosyluronic acid-(1->3)-2-acetamido-2-deoxy-4-O-sulfo-D-galacto-hexopyranose
| Molecular Formula | C14H23NO15S |
|---|---|
| Molecular Weight | 477.08 g/mol |
| LogP | -5.334 |
| Topological Polar Surface Area | 258.84 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.07883 |
| Heavy Atoms | 31 |
| Complexity | 760.81104 |
Chemical Identifiers
| CAS Number | 52259-40-2 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](OC1O)CO)OS(=O)(=O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
Product Overview
2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose (CAS 52259-40-2), with molecular formula C14H23NO15S and molecular weight 477.08 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[(3R,4R,5R,6R)-3-acetamido-2-hydroxy-6-(hydroxymethyl)-5-sulfooxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose
Property Insights of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose
The XLogP value of -5.334 indicates that 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 258.84 Ų indicates high polarity, suggesting 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose has 8 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose?
The CAS number of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose is 52259-40-2.
What is the molecular formula of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose?
The molecular formula of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose is C14H23NO15S.
What is the molecular weight of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose?
The molecular weight of 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose is 477.08 g/mol.
Where can I buy 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose?
You can request a quote for 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfo-D-galactopyranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.