Schottenol
TL;DR: Schottenol (CAS 521-03-9) 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.
(3S,5S,9R,10S,13R,14R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Schottenol, Scottenol, 22,23-Dihydrospinasterol, Stigmast-7-enol, 7-Stigmastenol
| Molecular Formula | C29H50O |
|---|---|
| Molecular Weight | 414.39 g/mol |
| LogP | 9.1 |
| 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 | 521-03-9 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C |
| InChIKey | YSKVBPGQYRAUQO-UZSYLJJSSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Schottenol (CAS 521-03-9), with molecular formula C29H50O and molecular weight 414.39 g/mol. IUPAC: (3S,5S,9R,10S,13R,14R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of Schottenol
Property Insights of Schottenol
The XLogP value of 9.1 indicates that Schottenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Schottenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Schottenol 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 Schottenol?
The CAS number of Schottenol is 521-03-9.
What is the molecular formula of Schottenol?
The molecular formula of Schottenol is C29H50O.
What is the molecular weight of Schottenol?
The molecular weight of Schottenol is 414.39 g/mol.
Where can I buy Schottenol?
You can request a quote for Schottenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Schottenol?
Yes, KEHONG BIO provides custom synthesis services for Schottenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.