3-O-Methylglycyrol
TL;DR: 3-O-Methylglycyrol (CAS 23013-85-6) is a chemical compound with molecular formula C22H20O6 and molecular weight 380.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-hydroxy-1,3-dimethoxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one
Also Known As: 3-O-Methylglycyrol, 5-O-Methylglycyrol, 1-O-Methylglycyrol, 5-O-Methyl glycyrol, 9-Hydroxy-1,3-dimethoxy-2-prenylcoumestan
| Molecular Formula | C22H20O6 |
|---|---|
| Molecular Weight | 380.13 g/mol |
| LogP | 4.9239 |
| Topological Polar Surface Area | 82.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.12598 |
| Heavy Atoms | 28 |
| Complexity | 1302.0898 |
Chemical Identifiers
| CAS Number | 23013-85-6 |
|---|---|
| SMILES | CC(=CCC1=C(C=C2C(=C1OC)C3=C(C4=C(O3)C=C(C=C4)O)C(=O)O2)OC)C |
Product Overview
3-O-Methylglycyrol (CAS 23013-85-6), with molecular formula C22H20O6 and molecular weight 380.13 g/mol. IUPAC: 9-hydroxy-1,3-dimethoxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one.
Chemical Property Profile of 3-O-Methylglycyrol
Property Insights of 3-O-Methylglycyrol
The XLogP value of 4.9239 indicates that 3-O-Methylglycyrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-O-Methylglycyrol. Following Lipinski's Rule of Five, 3-O-Methylglycyrol has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-O-Methylglycyrol?
The CAS number of 3-O-Methylglycyrol is 23013-85-6.
What is the molecular formula of 3-O-Methylglycyrol?
The molecular formula of 3-O-Methylglycyrol is C22H20O6.
What is the molecular weight of 3-O-Methylglycyrol?
The molecular weight of 3-O-Methylglycyrol is 380.13 g/mol.
Where can I buy 3-O-Methylglycyrol?
You can request a quote for 3-O-Methylglycyrol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-O-Methylglycyrol?
Yes, KEHONG BIO provides custom synthesis services for 3-O-Methylglycyrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.