Deladumone
TL;DR: Deladumone (CAS 8064-65-1) is a chemical compound with molecular formula C49H72O6 and molecular weight 756.53 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] heptanoate;[(13S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate
Also Known As: Deladumone, (8xi,9xi,14xi)-3-Hydroxyestra-1(10),2,4-trien-17beta-yl pentanoate--3-oxoandrost-4-en-17beta-yl heptanoate (1/1), [(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] heptanoate; [(13S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate, 3-Hydroxyestra-1(10),2,4-trien-17-yl pentanoate--3-oxoandrost-4-en-17-yl heptanoate (1/1)
| Molecular Formula | C49H72O6 |
|---|---|
| Molecular Weight | 756.53 g/mol |
| LogP | 11.7508 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 756.5329 |
| Heavy Atoms | 55 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 8064-65-1 |
|---|---|
| SMILES | CCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C.CCCCC(=O)O[C@H]1CCC2[C@@]1(CCC3C2CCC4=C3C=CC(=C4)O)C |
| InChIKey | RVWDHKGCQPULBK-DVBNNDNZSA-N |
Product Overview
Deladumone (CAS 8064-65-1), with molecular formula C49H72O6 and molecular weight 756.53 g/mol. IUPAC: [(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] heptanoate;[(13S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate.
Chemical Property Profile of Deladumone
Property Insights of Deladumone
The XLogP value of 11.7508 indicates that Deladumone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Deladumone. Following Lipinski's Rule of Five, Deladumone has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deladumone?
The CAS number of Deladumone is 8064-65-1.
What is the molecular formula of Deladumone?
The molecular formula of Deladumone is C49H72O6.
What is the molecular weight of Deladumone?
The molecular weight of Deladumone is 756.53 g/mol.
Where can I buy Deladumone?
You can request a quote for Deladumone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deladumone?
Yes, KEHONG BIO provides custom synthesis services for Deladumone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.