17α-羟孕烯醇酮
TL;DR: 17α-羟孕烯醇酮 (CAS 387-79-1) is a chemical compound with molecular formula C21H32O3 and molecular weight 332.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17α-羟孕烯醇酮
1-[(3S,8R,9S,10R,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Also Known As: 17-Hydroxypregnenolone, 17alpha-Hydroxypregnenolone, 17a-Hydroxypregnenolone, 17-OH-pregnenolone, 17-alpha-Hydroxypregnenolone
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 596.0 |
| Melting Point | 266 - 271 °C |
Chemical Identifiers
| CAS Number | 387-79-1 |
|---|---|
| SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)O |
| InChIKey | JERGUCIJOXJXHF-TVWVXWENSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
17α-羟孕烯醇酮 (CAS 387-79-1), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: 1-[(3S,8R,9S,10R,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone.
Chemical Property Profile of 17α-羟孕烯醇酮
Property Insights of 17α-羟孕烯醇酮
The XLogP value of 3.1 indicates that 17α-羟孕烯醇酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 17α-羟孕烯醇酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17α-羟孕烯醇酮 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 17α-羟孕烯醇酮?
The CAS number of 17α-羟孕烯醇酮 is 387-79-1.
What is the molecular formula of 17α-羟孕烯醇酮?
The molecular formula of 17α-羟孕烯醇酮 is C21H32O3.
What is the molecular weight of 17α-羟孕烯醇酮?
The molecular weight of 17α-羟孕烯醇酮 is 332.24 g/mol.
Where can I buy 17α-羟孕烯醇酮?
You can request a quote for 17α-羟孕烯醇酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17α-羟孕烯醇酮?
Yes, KEHONG BIO provides custom synthesis services for 17α-羟孕烯醇酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.