7-Deoxydaunomycinone
TL;DR: 7-Deoxydaunomycinone (CAS 40755-39-3) is a chemical compound with molecular formula C21H18O7 and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-acetyl-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: 7-Deoxydaunomycinone, 7-Desoxydaunomycinone, 7-deoxydaumycinone, 7-Deoxydaunorubicin aglycone, Doxorubicin Impurity 32
| Molecular Formula | C21H18O7 |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.10526 |
| Heavy Atoms | 28 |
| Complexity | 690.0 |
Chemical Identifiers
| CAS Number | 40755-39-3 |
|---|---|
| SMILES | CC(=O)C1(CCC2=C(C1)C(=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4OC)O)O |
| InChIKey | SAMGALZMSQPNHS-UHFFFAOYSA-N |
Product Overview
7-Deoxydaunomycinone (CAS 40755-39-3), with molecular formula C21H18O7 and molecular weight 382.11 g/mol. IUPAC: 9-acetyl-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of 7-Deoxydaunomycinone
Property Insights of 7-Deoxydaunomycinone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Deoxydaunomycinone. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Deoxydaunomycinone. Following Lipinski's Rule of Five, 7-Deoxydaunomycinone has 3 hydrogen bond donor(s) and 7 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 7-Deoxydaunomycinone?
The CAS number of 7-Deoxydaunomycinone is 40755-39-3.
What is the molecular formula of 7-Deoxydaunomycinone?
The molecular formula of 7-Deoxydaunomycinone is C21H18O7.
What is the molecular weight of 7-Deoxydaunomycinone?
The molecular weight of 7-Deoxydaunomycinone is 382.11 g/mol.
Where can I buy 7-Deoxydaunomycinone?
You can request a quote for 7-Deoxydaunomycinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Deoxydaunomycinone?
Yes, KEHONG BIO provides custom synthesis services for 7-Deoxydaunomycinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.