Azadirachtol
TL;DR: Azadirachtol (CAS 101508-37-6) is a chemical compound with molecular formula C32H46O6 and molecular weight 526.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5R,7R,9R,10S,11R,13S,17R)-11-hydroxy-17-[(2S,5R)-2-hydroxy-5-(2-methylpropyl)-2,5-dihydrofuran-3-yl]-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate
Also Known As: Azadirachtol, (8xi,21S,23R)-11alpha,21-Dihydroxy-4,4,8-trimethyl-3-oxo-5alpha,13alpha,17alpha-21,23-epoxycholesta-1,14,20(22)-trien-7alpha-yl acetate, [(5R,7R,9R,10S,11R,13S,17R)-11-hydroxy-17-[(2S,5R)-2-hydroxy-5-(2-methylpropyl)-2,5-dihydrofuran-3-yl]-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate, 11,21-Dihydroxy-4,4,8-trimethyl-3-oxo-21,23-epoxycholesta-1,14,20(22)-trien-7-yl acetate
| Molecular Formula | C32H46O6 |
|---|---|
| Molecular Weight | 526.33 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 526.32947 |
| Heavy Atoms | 38 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 101508-37-6 |
|---|---|
| SMILES | CC(C)C[C@@H]1C=C([C@H](O1)O)[C@@H]2CC=C3[C@]2(C[C@H]([C@H]4C3([C@@H](C[C@@H]5[C@@]4(C=CC(=O)C5(C)C)C)OC(=O)C)C)O)C |
| InChIKey | MUYYQGZLSSBBNW-MXCLQDMSSA-N |
Product Overview
Azadirachtol (CAS 101508-37-6), with molecular formula C32H46O6 and molecular weight 526.33 g/mol. IUPAC: [(5R,7R,9R,10S,11R,13S,17R)-11-hydroxy-17-[(2S,5R)-2-hydroxy-5-(2-methylpropyl)-2,5-dihydrofuran-3-yl]-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate.
Chemical Property Profile of Azadirachtol
Property Insights of Azadirachtol
The XLogP value of 4.4 indicates that Azadirachtol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Azadirachtol. Following Lipinski's Rule of Five, Azadirachtol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Azadirachtol?
The CAS number of Azadirachtol is 101508-37-6.
What is the molecular formula of Azadirachtol?
The molecular formula of Azadirachtol is C32H46O6.
What is the molecular weight of Azadirachtol?
The molecular weight of Azadirachtol is 526.33 g/mol.
Where can I buy Azadirachtol?
You can request a quote for Azadirachtol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azadirachtol?
Yes, KEHONG BIO provides custom synthesis services for Azadirachtol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.