Helenalin extract
TL;DR: Helenalin extract (CAS 73680-94-1) is a chemical compound with molecular formula C15H18O4 and molecular weight 262.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
Also Known As: HELENALIN, Helenalin extract, Mexicanin I, Mexiconin I, Deacetoxy-linifolin A
| Molecular Formula | C15H18O4 |
|---|---|
| Molecular Weight | 262.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.1205 |
| Heavy Atoms | 19 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 73680-94-1 |
|---|---|
| SMILES | CC1CC2C(C(C3(C1C=CC3=O)C)O)C(=C)C(=O)O2 |
| InChIKey | ZVLOPMNVFLSSAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Helenalin extract (CAS 73680-94-1), with molecular formula C15H18O4 and molecular weight 262.12 g/mol. IUPAC: 9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione.
Chemical Property Profile of Helenalin extract
Property Insights of Helenalin extract
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Helenalin extract. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Helenalin extract. Following Lipinski's Rule of Five, Helenalin extract has 1 hydrogen bond donor(s) and 4 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 Helenalin extract?
The CAS number of Helenalin extract is 73680-94-1.
What is the molecular formula of Helenalin extract?
The molecular formula of Helenalin extract is C15H18O4.
What is the molecular weight of Helenalin extract?
The molecular weight of Helenalin extract is 262.12 g/mol.
Where can I buy Helenalin extract?
You can request a quote for Helenalin extract directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Helenalin extract?
Yes, KEHONG BIO provides custom synthesis services for Helenalin extract and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.