TL;DR: Inokosterone (CAS 15130-85-5) is a chemical compound with molecular formula C27H44O7 and molecular weight 480.30872 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,14-trihydroxy-10,13-dimethyl-17-(2,3,7-trihydroxy-6-methylheptan-2-yl)-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Also Known As: Inokosterone, 25R-Inokosterone, 25S-Inokosterone, (25S)-Inokosterone, 25S-Inokosterone [M+H]+
| Molecular Formula | C27H44O7 |
| Molecular Weight | 480.30872 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.30872 Da |
| Heavy Atoms | 34 |
| Complexity | 843.0 |
| SMILES | CC(CCC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O)O)CO |
| InChIKey | JQNVCUBPURTQPQ-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Inokosterone. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Inokosterone. Following Lipinski's Rule of Five, Inokosterone has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Inokosterone is 15130-85-5.
The molecular formula of Inokosterone is C27H44O7.
The molecular weight of Inokosterone is 480.30872 g/mol.
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