(16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one
TL;DR: (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one (CAS 116169-22-3) is a chemical compound with molecular formula C26H38O2 and molecular weight 382.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aR,4bS,6aS,6bS,7S,10aR,11aS,11bR)-6b-acetyl-4a,6a,7-trimethyl-4,4b,5,6,7,8,9,10,10a,11,11a,11b,12,13-tetradecahydro-3H-indeno[2,1-a]phenanthren-2-one
Also Known As: 2'-Mchp, 2'-Methyl-16,17-cyclohexaneprogesterone, 2'-Methyl-16,17-cyclohexanoprogesterone, 17-Acetyl-16,24-cyclochol-4-en-3-one, (20S)-17-Acetyl-16beta-16,24-cyclochol-4-en-3-one
| Molecular Formula | C26H38O2 |
|---|---|
| Molecular Weight | 382.29 g/mol |
| LogP | 6.1398 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 382.28717 |
| Heavy Atoms | 28 |
| Complexity | 749.5318 |
Chemical Identifiers
| CAS Number | 116169-22-3 |
|---|---|
| SMILES | C[C@H]1CCC[C@H]2[C@@]1([C@]3(CC[C@H]4[C@H]([C@@H]3C2)CCC5=CC(=O)CC[C@]45C)C)C(=O)C |
Product Overview
(16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one (CAS 116169-22-3), with molecular formula C26H38O2 and molecular weight 382.29 g/mol. IUPAC: (4aR,4bS,6aS,6bS,7S,10aR,11aS,11bR)-6b-acetyl-4a,6a,7-trimethyl-4,4b,5,6,7,8,9,10,10a,11,11a,11b,12,13-tetradecahydro-3H-indeno[2,1-a]phenanthren-2-one.
Chemical Property Profile of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one
Property Insights of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one
The XLogP value of 6.1398 indicates that (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one?
The CAS number of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one is 116169-22-3.
What is the molecular formula of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one?
The molecular formula of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one is C26H38O2.
What is the molecular weight of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one?
The molecular weight of (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one is 382.29 g/mol.
Where can I buy (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one?
You can request a quote for (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for (16beta,17alpha,20S)-17-Acetyl-16,24-cyclochol-4-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.