Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside
TL;DR: Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside (CAS 137809-96-2) is a chemical compound with molecular formula C28H32O16 and molecular weight 624.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
Also Known As: C-7-Mpap, Desacetyloppositifolin, Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside, Chrysoeriol-7-O-(2/'-O-mannopyranosyl)allopyranoside, 7-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
| Molecular Formula | C28H32O16 |
|---|---|
| Molecular Weight | 624.17 g/mol |
| LogP | -2.1173 |
| Topological Polar Surface Area | 258.43 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 624.169 |
| Heavy Atoms | 44 |
| Complexity | 1523.5035 |
Chemical Identifiers
| CAS Number | 137809-96-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O[C@H]5[C@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O |
Product Overview
Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside (CAS 137809-96-2), with molecular formula C28H32O16 and molecular weight 624.17 g/mol. IUPAC: 7-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one.
Chemical Property Profile of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside
Property Insights of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside
The XLogP value of -2.1173 indicates that Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 258.43 Ų indicates high polarity, suggesting Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside has 9 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside?
The CAS number of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside is 137809-96-2.
What is the molecular formula of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside?
The molecular formula of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside is C28H32O16.
What is the molecular weight of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside?
The molecular weight of Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside is 624.17 g/mol.
Where can I buy Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside?
You can request a quote for Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Chrysoeriol-7-O-(2''-O-mannopyranosyl)allopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.