TL;DR: (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one (CAS 126576-88-3) is a chemical compound with molecular formula C29H48O and molecular weight 412.3705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10,13-dimethyl-17-[(Z)-5-propan-2-ylhept-5-en-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Also Known As: (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one, (24Z)-Stigmast-24(28)-en-3-one, 2,15-dimethyl-14-[(5Z)-5-(propan-2-yl)hept-5-en-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-one, 10,13-dimethyl-17-[(Z)-5-propan-2-ylhept-5-en-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C29H48O |
| Molecular Weight | 412.3705 g/mol |
| XLogP | 9.3 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.3705 Da |
| Heavy Atoms | 30 |
| Complexity | 674.0 |
| SMILES | C/C=C(/CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C)\C(C)C |
| InChIKey | ARTLJRSXUMKHFS-YXSASFKJSA-N |
The XLogP value of 9.3 indicates that (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one is 126576-88-3.
The molecular formula of (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one is C29H48O.
The molecular weight of (5alpha,24(28)Z)-Stigmast-24(28)-en-3-one is 412.3705 g/mol.
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