Bersenogenin
TL;DR: Bersenogenin (CAS 30344-97-9) is a chemical compound with molecular formula C24H30O6 and molecular weight 414.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
Also Known As: BERSENOGENIN, NCI60_002015, 5,14,16-Trihydroxy-19-oxobufa-3,20,22-trienolide, 5,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
| Molecular Formula | C24H30O6 |
|---|---|
| Molecular Weight | 414.20 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.20422 |
| Heavy Atoms | 30 |
| Complexity | 875.0 |
Chemical Identifiers
| CAS Number | 30344-97-9 |
|---|---|
| SMILES | CC12CCC3C(C1(CC(C2C4=COC(=O)C=C4)O)O)CCC5(C3(CCC=C5)C=O)O |
| InChIKey | GJMVUWVCQBSDQU-UHFFFAOYSA-N |
Product Overview
Bersenogenin (CAS 30344-97-9), with molecular formula C24H30O6 and molecular weight 414.20 g/mol. IUPAC: 5,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde.
Chemical Property Profile of Bersenogenin
Property Insights of Bersenogenin
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bersenogenin. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bersenogenin. Following Lipinski's Rule of Five, Bersenogenin 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 Bersenogenin?
The CAS number of Bersenogenin is 30344-97-9.
What is the molecular formula of Bersenogenin?
The molecular formula of Bersenogenin is C24H30O6.
What is the molecular weight of Bersenogenin?
The molecular weight of Bersenogenin is 414.20 g/mol.
Where can I buy Bersenogenin?
You can request a quote for Bersenogenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bersenogenin?
Yes, KEHONG BIO provides custom synthesis services for Bersenogenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.