Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside
TL;DR: Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside (CAS 87321-98-0) is a chemical compound with molecular formula C21H31NO10 and molecular weight 457.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S,3R,4R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-phenylmethoxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide
Also Known As: BADFG, Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside, alpha-D-Galactopyranoside, phenylmethyl 2-(acetylamino)-2-deoxy-3-O-(6-deoxy-beta-D-galactopyranosyl)-, (6R-(6alpha,7beta(Z)))-, Benzyl 2-deoxy-3-O-(6-deoxyhexopyranosyl)-2-[(1-hydroxyethylidene)amino]hexopyranoside, Benzyl 2-deoxy-3-O-(6-deoxy-beta-D-galactopyranosyl)-2-[(1-hydroxyethylidene)amino]-alpha-D-galactopyranoside
| Molecular Formula | C21H31NO10 |
|---|---|
| Molecular Weight | 457.19 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.1948 |
| Heavy Atoms | 32 |
| Complexity | 603.0 |
Chemical Identifiers
| CAS Number | 87321-98-0 |
|---|---|
| SMILES | C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](O[C@@H]([C@@H]2O)CO)OCC3=CC=CC=C3)NC(=O)C)O)O)O |
| InChIKey | VDRQKNRHLMGFAK-QAYXKSKNSA-N |
Product Overview
Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside (CAS 87321-98-0), with molecular formula C21H31NO10 and molecular weight 457.19 g/mol. IUPAC: N-[(2S,3R,4R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-phenylmethoxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide.
Chemical Property Profile of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside
Property Insights of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside
The XLogP value of -1.8 indicates that Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.0 Ų indicates high polarity, suggesting Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside?
The CAS number of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside is 87321-98-0.
What is the molecular formula of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside?
The molecular formula of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside is C21H31NO10.
What is the molecular weight of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside?
The molecular weight of Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside is 457.19 g/mol.
Where can I buy Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside?
You can request a quote for Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-acetamido-2-deoxy-3-O-beta fucopyranosyl-alpha-galactopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.