17beta,21beta-Epoxyhopan-3-one
TL;DR: 17beta,21beta-Epoxyhopan-3-one (CAS 131985-08-5) is a chemical compound with molecular formula C30H48O2 and molecular weight 440.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,5S,7S,10R,11S,14R,15R,20R)-1,2,10,15,19,19-hexamethyl-7-propan-2-yl-6-oxahexacyclo[12.8.0.02,11.05,7.05,10.015,20]docosan-18-one
Also Known As: 17beta,21beta-Epoxyhopan-3-one, 17,21-epoxyhopan-3-one, 17beta,21beta-Epoxyhopane-3-one, J1.763.598K, (1R,2R,5S,7S,10R,11S,14R,15R,20R)-1,2,10,15,19,19-hexamethyl-7-propan-2-yl-6-oxahexacyclo[12.8.0.02,11.05,7.05,10.015,20]docosan-18-one
| Molecular Formula | C30H48O2 |
|---|---|
| Molecular Weight | 440.37 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 440.36542 |
| Heavy Atoms | 32 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 131985-08-5 |
|---|---|
| SMILES | CC(C)[C@@]12CC[C@]3([C@@]1(O2)CC[C@@]4([C@@H]3CC[C@H]5[C@]4(CC[C@@H]6[C@@]5(CCC(=O)C6(C)C)C)C)C)C |
| InChIKey | CMWZPPYBIGXKPR-LPSJIVJRSA-N |
Product Overview
17beta,21beta-Epoxyhopan-3-one (CAS 131985-08-5), with molecular formula C30H48O2 and molecular weight 440.37 g/mol. IUPAC: (1R,2R,5S,7S,10R,11S,14R,15R,20R)-1,2,10,15,19,19-hexamethyl-7-propan-2-yl-6-oxahexacyclo[12.8.0.02,11.05,7.05,10.015,20]docosan-18-one.
Chemical Property Profile of 17beta,21beta-Epoxyhopan-3-one
Property Insights of 17beta,21beta-Epoxyhopan-3-one
The XLogP value of 7.8 indicates that 17beta,21beta-Epoxyhopan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.6 Ų, 17beta,21beta-Epoxyhopan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17beta,21beta-Epoxyhopan-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 17beta,21beta-Epoxyhopan-3-one?
The CAS number of 17beta,21beta-Epoxyhopan-3-one is 131985-08-5.
What is the molecular formula of 17beta,21beta-Epoxyhopan-3-one?
The molecular formula of 17beta,21beta-Epoxyhopan-3-one is C30H48O2.
What is the molecular weight of 17beta,21beta-Epoxyhopan-3-one?
The molecular weight of 17beta,21beta-Epoxyhopan-3-one is 440.37 g/mol.
Where can I buy 17beta,21beta-Epoxyhopan-3-one?
You can request a quote for 17beta,21beta-Epoxyhopan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17beta,21beta-Epoxyhopan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 17beta,21beta-Epoxyhopan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.