栗甾酮
TL;DR: 栗甾酮 (CAS 85232-93-5) is a chemical compound with molecular formula C28H48O5 and molecular weight 464.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
栗甾酮
(2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
Also Known As: Castasterone, 24-Epicastasterone, BP 214, KST-1A8567, 6-oxo-campestan-2alpha,3alpha,22R,23R-tetrol
| Molecular Formula | C28H48O5 |
|---|---|
| Molecular Weight | 464.35 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 464.3502 |
| Heavy Atoms | 33 |
| Complexity | 738.0 |
Chemical Identifiers
| CAS Number | 85232-93-5 |
|---|---|
| SMILES | C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)[C@H]([C@@H]([C@@H](C)C(C)C)O)O |
| InChIKey | VYUIKSFYFRVQLF-YLNAYWRASA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
栗甾酮 (CAS 85232-93-5), with molecular formula C28H48O5 and molecular weight 464.35 g/mol. IUPAC: (2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one.
Chemical Property Profile of 栗甾酮
Property Insights of 栗甾酮
The XLogP value of 4.7 indicates that 栗甾酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 栗甾酮. Following Lipinski's Rule of Five, 栗甾酮 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 栗甾酮?
The CAS number of 栗甾酮 is 85232-93-5.
What is the molecular formula of 栗甾酮?
The molecular formula of 栗甾酮 is C28H48O5.
What is the molecular weight of 栗甾酮?
The molecular weight of 栗甾酮 is 464.35 g/mol.
Where can I buy 栗甾酮?
You can request a quote for 栗甾酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 栗甾酮?
Yes, KEHONG BIO provides custom synthesis services for 栗甾酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.