TL;DR: Etiocholenic acid (CAS 10325-79-8) is a chemical compound with molecular formula C20H30O3 and molecular weight 318.21948 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid
Also Known As: Etiocholenic acid, Etienic acid, Finasteride Impurity 52, A-Hydroxy-5-etienic acid, A-Hydroxyetio-5-cholenic acid
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H30O3 |
| Molecular Weight | 318.21948 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.21948 Da |
| Heavy Atoms | 23 |
| Complexity | 553.0 |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)O)CC=C4[C@@]3(CC[C@@H](C4)O)C |
| InChIKey | MGMOLZNAUACBCR-WQBJWTDHSA-N |
The XLogP value of 4.1 indicates that Etiocholenic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, Etiocholenic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Etiocholenic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Etiocholenic acid is 10325-79-8.
The molecular formula of Etiocholenic acid is C20H30O3.
The molecular weight of Etiocholenic acid is 318.21948 g/mol.
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