Cyrtominetin
TL;DR: Cyrtominetin (CAS 95272-99-4) is a chemical compound with molecular formula C17H16O6 and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethyl-2,3-dihydrochromen-4-one
Also Known As: Cyrtominetin, Cyrtomin, 3-hydroxyfarrerol, Idb 1031, MEGxp0_000359
| Molecular Formula | C17H16O6 |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.0947 |
| Heavy Atoms | 23 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 95272-99-4 |
|---|---|
| SMILES | CC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=CC(=C(C=C3)O)O)C)O |
| InChIKey | AESMRHCYHARBLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyrtominetin (CAS 95272-99-4), with molecular formula C17H16O6 and molecular weight 316.09 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethyl-2,3-dihydrochromen-4-one.
Chemical Property Profile of Cyrtominetin
Property Insights of Cyrtominetin
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyrtominetin. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyrtominetin. Following Lipinski's Rule of Five, Cyrtominetin has 4 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 Cyrtominetin?
The CAS number of Cyrtominetin is 95272-99-4.
What is the molecular formula of Cyrtominetin?
The molecular formula of Cyrtominetin is C17H16O6.
What is the molecular weight of Cyrtominetin?
The molecular weight of Cyrtominetin is 316.09 g/mol.
Where can I buy Cyrtominetin?
You can request a quote for Cyrtominetin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyrtominetin?
Yes, KEHONG BIO provides custom synthesis services for Cyrtominetin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.