Mexrenoic acid
TL;DR: Mexrenoic acid (CAS 41020-68-2) is a chemical compound with molecular formula C24H34O6 and molecular weight 418.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(7R,8R,9S,10R,13S,14S,17R)-17-hydroxy-7-methoxycarbonyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid
Also Known As: Mexrenoic acid, mexrenoate, Pregn-4-ene-7,21-dicarboxylic acid, 17-hydroxy-3-oxo-, 7-methyl ester, (17R)-17-Hydroxy-3-oxopregn-4-ene-7alpha,21-dicarboxylic acid 7-methyl ester, 3-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-1-hydroxy-4-(methoxycarbonyl)-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]propanoic acid
| Molecular Formula | C24H34O6 |
|---|---|
| Molecular Weight | 418.24 g/mol |
| LogP | 3.5133 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.23553 |
| Heavy Atoms | 30 |
| Complexity | 801.5179 |
Chemical Identifiers
| CAS Number | 41020-68-2 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1C[C@H]([C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(CCC(=O)O)O)C)C(=O)OC |
Product Overview
Mexrenoic acid (CAS 41020-68-2), with molecular formula C24H34O6 and molecular weight 418.24 g/mol. IUPAC: 3-[(7R,8R,9S,10R,13S,14S,17R)-17-hydroxy-7-methoxycarbonyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid.
Chemical Property Profile of Mexrenoic acid
Property Insights of Mexrenoic acid
The XLogP value of 3.5133 indicates that Mexrenoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Mexrenoic acid. Following Lipinski's Rule of Five, Mexrenoic acid has 2 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 Mexrenoic acid?
The CAS number of Mexrenoic acid is 41020-68-2.
What is the molecular formula of Mexrenoic acid?
The molecular formula of Mexrenoic acid is C24H34O6.
What is the molecular weight of Mexrenoic acid?
The molecular weight of Mexrenoic acid is 418.24 g/mol.
Where can I buy Mexrenoic acid?
You can request a quote for Mexrenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mexrenoic acid?
Yes, KEHONG BIO provides custom synthesis services for Mexrenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.