| SpectraBase Compound ID | LCbu2nBvdzI |
|---|---|
| InChI | InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,19-20,22,24-27H,8-18H2,1-6H3/b21-7- |
| InChIKey | ARTLJRSXUMKHFS-YXSASFKJSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C29H48O |
| Exact Mass | 412.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L5OQnxSDXAi |
|---|---|
| Name | Stigmast-24(28)-en-3-one, (5.alpha.)- |
| CAS Registry Number | 55123-75-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48O |
| InChI | InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,19-20,22,24-27H,8-18H2,1-6H3/b21-7- |
| InChIKey | ARTLJRSXUMKHFS-YXSASFKJSA-N |
| Molecular Weight | 412.702 g/mol |
| SMILES | C\C=C\(CCC(C)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C)C(C)C |
| SPLASH | splash10-02ai-9655000000-d909259fbbb01b54b8ef |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | (24Z)-Stigmast-24(28)-en-3-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 17-[(Z)-4-isopropyl-1-methyl-hex-4-enyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one |
| Wiley ID | 1374722 |