Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-
TL;DR: Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- (CAS 15207-30-4) is a chemical compound with molecular formula C25H36O6 and molecular weight 432.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]-4-oxobutanoic acid
Also Known As: Hydroxydione-21-succinate, Hydroxydionhydrogensuccinat, Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-, 4-[(3,20-dioxopregnan-21-yl)oxy]-4-oxobutanoic acid, Pregnane-3,20-dione,21-(3-carboxy-1-oxopropoxy)- (9CI)
| Molecular Formula | C25H36O6 |
|---|---|
| Molecular Weight | 432.25 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 97.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.2512 |
| Heavy Atoms | 31 |
| Complexity | 774.0 |
Chemical Identifiers
| CAS Number | 15207-30-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)COC(=O)CCC(=O)O)CCC4[C@@]3(CCC(=O)C4)C |
| InChIKey | KLRNMIUKAXHHFS-LCOKDZCBSA-N |
Product Overview
Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- (CAS 15207-30-4), with molecular formula C25H36O6 and molecular weight 432.25 g/mol. IUPAC: 4-[2-[(8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]-4-oxobutanoic acid.
Chemical Property Profile of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-
Property Insights of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-
The XLogP value of 3.8 indicates that Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-. Following Lipinski's Rule of Five, Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- has 1 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 Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-?
The CAS number of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- is 15207-30-4.
What is the molecular formula of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-?
The molecular formula of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- is C25H36O6.
What is the molecular weight of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-?
The molecular weight of Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- is 432.25 g/mol.
Where can I buy Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-?
You can request a quote for Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.