Petrosterol
TL;DR: Petrosterol (CAS 779-24-8) is a chemical compound with molecular formula C29H48O and molecular weight 412.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R,5R)-5-[(1R,2R)-2-methylcyclopropyl]hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Petrosterol, (25R)-24R,26R-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol, (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R,5R)-5-[(1R,2R)-2-methylcyclopropyl]hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol, (24R,25R,26R)-24,26-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol, 26,27-Dinorcholest-5-en-3-ol, 24-(2-methylcyclopropyl)-, (3beta,24R(1S,2R))-
| Molecular Formula | C29H48O |
|---|---|
| Molecular Weight | 412.37 g/mol |
| LogP | 8.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.3705 |
| Heavy Atoms | 30 |
| Complexity | 680.0 |
Chemical Identifiers
| CAS Number | 779-24-8 |
|---|---|
| SMILES | C[C@@H]1C[C@H]1[C@H](C)CC[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)O)C)C |
| InChIKey | AOOVLQXWRHMRMX-BFPAFGTMSA-N |
Product Overview
Petrosterol (CAS 779-24-8), with molecular formula C29H48O and molecular weight 412.37 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R,5R)-5-[(1R,2R)-2-methylcyclopropyl]hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of Petrosterol
Property Insights of Petrosterol
The XLogP value of 8.8 indicates that Petrosterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Petrosterol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Petrosterol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Petrosterol?
The CAS number of Petrosterol is 779-24-8.
What is the molecular formula of Petrosterol?
The molecular formula of Petrosterol is C29H48O.
What is the molecular weight of Petrosterol?
The molecular weight of Petrosterol is 412.37 g/mol.
Where can I buy Petrosterol?
You can request a quote for Petrosterol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Petrosterol?
Yes, KEHONG BIO provides custom synthesis services for Petrosterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.