| SpectraBase Compound ID | L7qkXZm0wZr |
|---|---|
| InChI | InChI=1S/C27H42O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h8,17,20-24H,6-7,9-16H2,1-5H3/b18-8+ |
| InChIKey | DVERXJHYDBMZEG-QGMBQPNBSA-N |
| Mol Weight | 398.6 g/mol |
| Molecular Formula | C27H42O2 |
| Exact Mass | 398.318481 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JreqKk4AVmD |
|---|---|
| Name | Cholest-20(22)-ene-3,6-dione, (5.alpha.)- |
| CAS Registry Number | 41084-10-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H42O2 |
| InChI | InChI=1S/C27H42O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h8,17,20-24H,6-7,9-16H2,1-5H3/b18-8+ |
| InChIKey | DVERXJHYDBMZEG-QGMBQPNBSA-N |
| Molecular Weight | 398.631 g/mol |
| SMILES | CC(C)CC\C=C/(C)C1CCC2C3CC(=O)C4CC(=O)CCC4(C)C3CCC12C |
| SPLASH | splash10-05nb-9322000000-f593af4e6791a1f1a92f |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | (20E)-Cholest-20(22)-ene-3,6-dione 10,13-dimethyl-17-[(E)-6-methylhept-2-en-2-yl]-2,4,5,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-dione 17-[(E)-1,5-dimethylhex-1-enyl]-10,13-dimethyl-2,4,5,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-dione 17-[(E)-1,5-dimethylhex-1-enyl]-10,13-dimethyl-2,4,5,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-quinone |
| Wiley ID | 56985 |