3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione
TL;DR: 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione (CAS 34119-68-1) is a chemical compound with molecular formula C19H14O6 and molecular weight 338.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6,8-trihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Also Known As: Rabelomycin, 3,6,8-trihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione, 3,6,8-trihydroxy-3-methyl-3,4-dihydrotetraphene-1,7,12(2H)-trione, 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz[a]anthracene-1,7,12(2H)-trione, Benz(a)anthracene-1,7,12(2H)-trione, 3,4-dihydro-3,6,8-trihydroxy-3-methyl-, (-)-
| Molecular Formula | C19H14O6 |
|---|---|
| Molecular Weight | 338.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 338.07904 |
| Heavy Atoms | 25 |
| Complexity | 629.0 |
Chemical Identifiers
| CAS Number | 34119-68-1 |
|---|---|
| SMILES | CC1(CC2=CC(=C3C(=C2C(=O)C1)C(=O)C4=C(C3=O)C(=CC=C4)O)O)O |
| InChIKey | JJOLHRYZQSDLSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione (CAS 34119-68-1), with molecular formula C19H14O6 and molecular weight 338.08 g/mol. IUPAC: 3,6,8-trihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione.
Chemical Property Profile of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione
Property Insights of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione. Following Lipinski's Rule of Five, 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione 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 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione?
The CAS number of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione is 34119-68-1.
What is the molecular formula of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione?
The molecular formula of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione is C19H14O6.
What is the molecular weight of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione?
The molecular weight of 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione is 338.08 g/mol.
Where can I buy 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione?
You can request a quote for 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-3,6,8-trihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.