beta-D-GlcpA-(1->3)-D-GlcpNAc
TL;DR: beta-D-GlcpA-(1->3)-D-GlcpNAc (CAS 97747-46-1) is a chemical compound with molecular formula C14H23NO12 and molecular weight 397.12 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,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: N-Acetylchondrosine, (GlcA)1 (GlcNAc)1, GlyTouCan:G35674CY, beta-D-GlcpA-(1->3)-D-GlcpNAc, beta-D-GlcA-(1->3)-D-GlcNAc
| Molecular Formula | C14H23NO12 |
|---|---|
| Molecular Weight | 397.12 g/mol |
| LogP | -3.9 |
| Topological Polar Surface Area | 215.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.12204 |
| Heavy Atoms | 27 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 97747-46-1 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1O)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
| InChIKey | LJORHONFMDUUHP-ASXIHULMSA-N |
Product Overview
beta-D-GlcpA-(1->3)-D-GlcpNAc (CAS 97747-46-1), with molecular formula C14H23NO12 and molecular weight 397.12 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[(3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-GlcpA-(1->3)-D-GlcpNAc
Property Insights of beta-D-GlcpA-(1->3)-D-GlcpNAc
The XLogP value of -3.9 indicates that beta-D-GlcpA-(1->3)-D-GlcpNAc is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 215.0 Ų indicates high polarity, suggesting beta-D-GlcpA-(1->3)-D-GlcpNAc may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-D-GlcpA-(1->3)-D-GlcpNAc has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-D-GlcpA-(1->3)-D-GlcpNAc?
The CAS number of beta-D-GlcpA-(1->3)-D-GlcpNAc is 97747-46-1.
What is the molecular formula of beta-D-GlcpA-(1->3)-D-GlcpNAc?
The molecular formula of beta-D-GlcpA-(1->3)-D-GlcpNAc is C14H23NO12.
What is the molecular weight of beta-D-GlcpA-(1->3)-D-GlcpNAc?
The molecular weight of beta-D-GlcpA-(1->3)-D-GlcpNAc is 397.12 g/mol.
Where can I buy beta-D-GlcpA-(1->3)-D-GlcpNAc?
You can request a quote for beta-D-GlcpA-(1->3)-D-GlcpNAc directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-GlcpA-(1->3)-D-GlcpNAc?
Yes, KEHONG BIO provides custom synthesis services for beta-D-GlcpA-(1->3)-D-GlcpNAc and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.