槐角苷
TL;DR: 槐角苷 (CAS 100455-45-6) is a chemical compound with molecular formula C21H20O10 and molecular weight 432.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
槐角苷
5,7-dihydroxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Also Known As: Sophoricoside, Genistein sophoricoside, Genistein, A-glucoside, Genistein sophoricoside [MI]
| Molecular Formula | C21H20O10 |
|---|---|
| Molecular Weight | 432.11 g/mol |
| LogP | 0.0499 |
| Topological Polar Surface Area | 170.05 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.10565 |
| Heavy Atoms | 31 |
| Complexity | 1137.3458 |
Chemical Identifiers
| CAS Number | 100455-45-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Product Overview
槐角苷 (CAS 100455-45-6), with molecular formula C21H20O10 and molecular weight 432.11 g/mol. IUPAC: 5,7-dihydroxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one.
Chemical Property Profile of 槐角苷
Property Insights of 槐角苷
The XLogP value of 0.0499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 槐角苷. The TPSA of 170.05 Ų indicates high polarity, suggesting 槐角苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 槐角苷 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 槐角苷?
The CAS number of 槐角苷 is 100455-45-6.
What is the molecular formula of 槐角苷?
The molecular formula of 槐角苷 is C21H20O10.
What is the molecular weight of 槐角苷?
The molecular weight of 槐角苷 is 432.11 g/mol.
Where can I buy 槐角苷?
You can request a quote for 槐角苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 槐角苷?
Yes, KEHONG BIO provides custom synthesis services for 槐角苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.