Cholestan-6-one derivative
TL;DR: Cholestan-6-one derivative (CAS 93860-61-8) is a chemical compound with molecular formula C28H48O6 and molecular weight 480.3451 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2R,4R,5S,7S,11S,12S,16S)-15-[(2S,3R,4S,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one
Also Known As: Brassinolide, Cholestan-6-one derivative
Technical Specifications
| Molecular Formula | C28H48O6 |
| Molecular Weight | 480.3451 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.3451 Da |
| Heavy Atoms | 34 |
| Complexity | 755.0 |
| SMILES | C[C@@H](C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2COC(=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 | IXVMHGVQKLDRKH-DDRCPOAISA-N |
Chemical Property Profile of Cholestan-6-one derivative
Property Insights of Cholestan-6-one derivative
The XLogP value of 4.8 indicates that Cholestan-6-one derivative is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cholestan-6-one derivative. Following Lipinski's Rule of Five, Cholestan-6-one derivative has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Cholestan-6-one derivative?
The CAS number of Cholestan-6-one derivative is 93860-61-8.
What is the molecular formula of Cholestan-6-one derivative?
The molecular formula of Cholestan-6-one derivative is C28H48O6.
What is the molecular weight of Cholestan-6-one derivative?
The molecular weight of Cholestan-6-one derivative is 480.3451 g/mol.
Where can I buy Cholestan-6-one derivative?
You can request a quote for Cholestan-6-one derivative directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cholestan-6-one derivative?
Yes, CoreyChem provides custom synthesis services for Cholestan-6-one derivative and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.