本胆烯酸
TL;DR: 本胆烯酸 (CAS 10325-79-8) is a chemical compound with molecular formula C20H30O3 and molecular weight 318.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
本胆烯酸
(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
| Molecular Formula | C20H30O3 |
|---|---|
| Molecular Weight | 318.22 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.21948 |
| Heavy Atoms | 23 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 10325-79-8 |
|---|---|
| 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 |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
本胆烯酸 (CAS 10325-79-8), with molecular formula C20H30O3 and molecular weight 318.22 g/mol. IUPAC: (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.
Chemical Property Profile of 本胆烯酸
Property Insights of 本胆烯酸
The XLogP value of 4.1 indicates that 本胆烯酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 本胆烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 本胆烯酸 has 2 hydrogen bond donor(s) and 3 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 本胆烯酸?
The CAS number of 本胆烯酸 is 10325-79-8.
What is the molecular formula of 本胆烯酸?
The molecular formula of 本胆烯酸 is C20H30O3.
What is the molecular weight of 本胆烯酸?
The molecular weight of 本胆烯酸 is 318.22 g/mol.
Where can I buy 本胆烯酸?
You can request a quote for 本胆烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 本胆烯酸?
Yes, KEHONG BIO provides custom synthesis services for 本胆烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.