(+)-Catechin-5-O-beta-D-glucopyranoside
TL;DR: (+)-Catechin-5-O-beta-D-glucopyranoside (CAS 88126-53-8) is a chemical compound with molecular formula C21H24O11 and molecular weight 452.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Catechin 5-glucoside, (+)-Catechin-5-O-glucoside, (+)-Catechin 5-O-beta-D-glucopyranoside, (+)-Catechin-5-O-beta-D-glucopyranoside, (+)-Catechin-5-O-I(2)-D-glucopyranoside
| Molecular Formula | C21H24O11 |
|---|---|
| Molecular Weight | 452.13 g/mol |
| LogP | -0.9808 |
| Topological Polar Surface Area | 189.53 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.13187 |
| Heavy Atoms | 32 |
| Complexity | 978.4585 |
Chemical Identifiers
| CAS Number | 88126-53-8 |
|---|---|
| SMILES | C1[C@@H]([C@H](OC2=C1C(=CC(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O |
Product Overview
(+)-Catechin-5-O-beta-D-glucopyranoside (CAS 88126-53-8), with molecular formula C21H24O11 and molecular weight 452.13 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of (+)-Catechin-5-O-beta-D-glucopyranoside
Property Insights of (+)-Catechin-5-O-beta-D-glucopyranoside
The XLogP value of -0.9808 indicates that (+)-Catechin-5-O-beta-D-glucopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 189.53 Ų indicates high polarity, suggesting (+)-Catechin-5-O-beta-D-glucopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (+)-Catechin-5-O-beta-D-glucopyranoside has 8 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (+)-Catechin-5-O-beta-D-glucopyranoside?
The CAS number of (+)-Catechin-5-O-beta-D-glucopyranoside is 88126-53-8.
What is the molecular formula of (+)-Catechin-5-O-beta-D-glucopyranoside?
The molecular formula of (+)-Catechin-5-O-beta-D-glucopyranoside is C21H24O11.
What is the molecular weight of (+)-Catechin-5-O-beta-D-glucopyranoside?
The molecular weight of (+)-Catechin-5-O-beta-D-glucopyranoside is 452.13 g/mol.
Where can I buy (+)-Catechin-5-O-beta-D-glucopyranoside?
You can request a quote for (+)-Catechin-5-O-beta-D-glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Catechin-5-O-beta-D-glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for (+)-Catechin-5-O-beta-D-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.