8'-Hydroxyzearalenone
TL;DR: 8'-Hydroxyzearalenone (CAS 40785-64-6) is a chemical compound with molecular formula C18H22O6 and molecular weight 334.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,16,18-trihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione
Also Known As: 8'-Hydroxyzearalenone, 6,16,18-Trihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione, 3,4,5,6,9,10-Hexahydro-5,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione
| Molecular Formula | C18H22O6 |
|---|---|
| Molecular Weight | 334.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 334.14163 |
| Heavy Atoms | 24 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 40785-64-6 |
|---|---|
| SMILES | CC1CC(CC(=O)CCCC=CC2=C(C(=CC(=C2)O)O)C(=O)O1)O |
| InChIKey | GJFPDPNMJOCHCT-UHFFFAOYSA-N |
Product Overview
8'-Hydroxyzearalenone (CAS 40785-64-6), with molecular formula C18H22O6 and molecular weight 334.14 g/mol. IUPAC: 6,16,18-trihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione.
Chemical Property Profile of 8'-Hydroxyzearalenone
Property Insights of 8'-Hydroxyzearalenone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8'-Hydroxyzearalenone. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8'-Hydroxyzearalenone. Following Lipinski's Rule of Five, 8'-Hydroxyzearalenone has 3 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 8'-Hydroxyzearalenone?
The CAS number of 8'-Hydroxyzearalenone is 40785-64-6.
What is the molecular formula of 8'-Hydroxyzearalenone?
The molecular formula of 8'-Hydroxyzearalenone is C18H22O6.
What is the molecular weight of 8'-Hydroxyzearalenone?
The molecular weight of 8'-Hydroxyzearalenone is 334.14 g/mol.
Where can I buy 8'-Hydroxyzearalenone?
You can request a quote for 8'-Hydroxyzearalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8'-Hydroxyzearalenone?
Yes, KEHONG BIO provides custom synthesis services for 8'-Hydroxyzearalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.