Stigmast-5-en-3-ol
TL;DR: Stigmast-5-en-3-ol (CAS 5779-62-4) is a chemical compound with molecular formula C29H50O and molecular weight 414.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Stigmast-5-en-3-ol, Clionasterol, Sitosterol, Harzol, Azuprostat
| Molecular Formula | C29H50O |
|---|---|
| Molecular Weight | 414.39 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.38617 |
| Heavy Atoms | 30 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 5779-62-4 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCC(C4)O)C)C)C(C)C |
| InChIKey | KZJWDPNRJALLNS-BWRKXDIJSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Stigmast-5-en-3-ol (CAS 5779-62-4), with molecular formula C29H50O and molecular weight 414.39 g/mol. IUPAC: (8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of Stigmast-5-en-3-ol
Property Insights of Stigmast-5-en-3-ol
The XLogP value of 9.3 indicates that Stigmast-5-en-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Stigmast-5-en-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Stigmast-5-en-3-ol 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 Stigmast-5-en-3-ol?
The CAS number of Stigmast-5-en-3-ol is 5779-62-4.
What is the molecular formula of Stigmast-5-en-3-ol?
The molecular formula of Stigmast-5-en-3-ol is C29H50O.
What is the molecular weight of Stigmast-5-en-3-ol?
The molecular weight of Stigmast-5-en-3-ol is 414.39 g/mol.
Where can I buy Stigmast-5-en-3-ol?
You can request a quote for Stigmast-5-en-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stigmast-5-en-3-ol?
Yes, KEHONG BIO provides custom synthesis services for Stigmast-5-en-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.