Hatomarubigin C
TL;DR: Hatomarubigin C (CAS 139501-92-1) is a chemical compound with molecular formula C20H18O5 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3S)-1,11-dihydroxy-8-methoxy-3-methyl-1,2,3,4-tetrahydrobenzo[a]anthracene-7,12-dione
Also Known As: Hatomarubigin C, hatomarubiginC, (1S,3S)-1,11-dihydroxy-8-methoxy-3-methyl-1,2,3,4-tetrahydrobenzo[a]anthracene-7,12-dione, Benz(a)anthracene-7,12-dione, 1,2,3,4-tetrahydro-1,11-dihydroxy-8-methoxy-3-methyl-, (1S-cis)-, (1S)-1beta,11-Dihydroxy-3beta-methyl-8-methoxy-1,2,3,4-tetrahydrobenz[a]anthracene-7,12-dione
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 139501-92-1 |
|---|---|
| SMILES | C[C@@H]1C[C@@H](C2=C(C1)C=CC3=C2C(=O)C4=C(C=CC(=C4C3=O)OC)O)O |
| InChIKey | CAEGIOZCLWNLAP-ZANVPECISA-N |
Product Overview
Hatomarubigin C (CAS 139501-92-1), with molecular formula C20H18O5 and molecular weight 338.12 g/mol. IUPAC: (1S,3S)-1,11-dihydroxy-8-methoxy-3-methyl-1,2,3,4-tetrahydrobenzo[a]anthracene-7,12-dione.
Chemical Property Profile of Hatomarubigin C
Property Insights of Hatomarubigin C
The XLogP value of 3.4 indicates that Hatomarubigin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Hatomarubigin C. Following Lipinski's Rule of Five, Hatomarubigin C has 2 hydrogen bond donor(s) and 5 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 Hatomarubigin C?
The CAS number of Hatomarubigin C is 139501-92-1.
What is the molecular formula of Hatomarubigin C?
The molecular formula of Hatomarubigin C is C20H18O5.
What is the molecular weight of Hatomarubigin C?
The molecular weight of Hatomarubigin C is 338.12 g/mol.
Where can I buy Hatomarubigin C?
You can request a quote for Hatomarubigin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hatomarubigin C?
Yes, KEHONG BIO provides custom synthesis services for Hatomarubigin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.