Dehydrorabelomycin
TL;DR: Dehydrorabelomycin (CAS 30954-70-2) is a chemical compound with molecular formula C19H12O5 and molecular weight 320.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,6,8-trihydroxy-3-methylbenzo[a]anthracene-7,12-dione
Also Known As: Dehydrorabelomycin, 6-Hydroxytetrangulol, Dehydroabelomycin, 1,6,8-trihydroxy-3-methylbenzo[a]anthracene-7,12-dione, 1,6,8-Trihydroxy-3-methylbenz[a]anthracene-7,12-dione
| Molecular Formula | C19H12O5 |
|---|---|
| Molecular Weight | 320.07 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 320.06848 |
| Heavy Atoms | 24 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 30954-70-2 |
|---|---|
| SMILES | CC1=CC2=CC(=C3C(=C2C(=C1)O)C(=O)C4=C(C3=O)C(=CC=C4)O)O |
| InChIKey | PQVIKROZFPIERS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dehydrorabelomycin (CAS 30954-70-2), with molecular formula C19H12O5 and molecular weight 320.07 g/mol. IUPAC: 1,6,8-trihydroxy-3-methylbenzo[a]anthracene-7,12-dione.
Chemical Property Profile of Dehydrorabelomycin
Property Insights of Dehydrorabelomycin
The XLogP value of 4.0 indicates that Dehydrorabelomycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dehydrorabelomycin. Following Lipinski's Rule of Five, Dehydrorabelomycin has 3 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 Dehydrorabelomycin?
The CAS number of Dehydrorabelomycin is 30954-70-2.
What is the molecular formula of Dehydrorabelomycin?
The molecular formula of Dehydrorabelomycin is C19H12O5.
What is the molecular weight of Dehydrorabelomycin?
The molecular weight of Dehydrorabelomycin is 320.07 g/mol.
Where can I buy Dehydrorabelomycin?
You can request a quote for Dehydrorabelomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydrorabelomycin?
Yes, KEHONG BIO provides custom synthesis services for Dehydrorabelomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.