TL;DR: Naheedin (CAS 106807-35-6) is a chemical compound with molecular formula C32H48O6 and molecular weight 528.3451 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(5R,7R,8R,9R,10S,11R,13S,17S)-17-[(2S,3R,5S)-5-butan-2-yl-2-hydroxyoxolan-3-yl]-11-hydroxy-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: Naheedin, 20,22-Dihydroazadirachtol, Azadirachtol, 20,22-dihydro-, [(5R,7R,8R,9R,10S,11R,13S,17S)-17-[(2S,3R,5S)-5-butan-2-yl-2-hydroxyoxolan-3-yl]-11-hydroxy-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate, Cholesta-1,14-dien-3-one, 7-(acetyloxy)-21,23-epoxy-11,21-dihydroxy-4,4,8-trimethyl-, (5alpha,7alpha,11alpha,13alpha,17alpha,21S,23R)-
| Molecular Formula | C32H48O6 |
| Molecular Weight | 528.3451 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 528.3451 Da |
| Heavy Atoms | 38 |
| Complexity | 1060.0 |
| SMILES | CCC(C)[C@@H]1C[C@@H]([C@H](O1)O)[C@@H]2CC=C3[C@]2(C[C@H]([C@H]4[C@]3([C@@H](C[C@@H]5[C@@]4(C=CC(=O)C5(C)C)C)OC(=O)C)C)O)C |
| InChIKey | WDFBTQUPHDHIQD-YUOXBHLDSA-N |
The XLogP value of 5.3 indicates that Naheedin 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 Naheedin. Following Lipinski's Rule of Five, Naheedin has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Naheedin is 106807-35-6.
The molecular formula of Naheedin is C32H48O6.
The molecular weight of Naheedin is 528.3451 g/mol.
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