Oroxin A
TL;DR: Oroxin A (CAS 31567-75-6) 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.
5,6-dihydroxy-2-phenyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Oroxin A, Baicalin-7-glucoside, Oroxin A [M+H]+, BAICALEIN 7-O-B-D-GLUCOPYRANOSIDE (BAICALIN), 5,6-dihydroxy-2-phenyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
| Molecular Formula | C21H20O10 |
|---|---|
| Molecular Weight | 432.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.10565 |
| Heavy Atoms | 31 |
| Complexity | 677.0 |
Chemical Identifiers
| CAS Number | 31567-75-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O |
| InChIKey | IPQKDIRUZHOIOM-UHFFFAOYSA-N |
Product Overview
Oroxin A (CAS 31567-75-6), with molecular formula C21H20O10 and molecular weight 432.11 g/mol. IUPAC: 5,6-dihydroxy-2-phenyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Oroxin A
Property Insights of Oroxin A
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oroxin A. The TPSA of 166.0 Ų indicates high polarity, suggesting Oroxin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Oroxin A 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 Oroxin A?
The CAS number of Oroxin A is 31567-75-6.
What is the molecular formula of Oroxin A?
The molecular formula of Oroxin A is C21H20O10.
What is the molecular weight of Oroxin A?
The molecular weight of Oroxin A is 432.11 g/mol.
Where can I buy Oroxin A?
You can request a quote for Oroxin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oroxin A?
Yes, KEHONG BIO provides custom synthesis services for Oroxin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.