| SpectraBase Spectrum ID |
IVUxDmU70nZ |
| Name |
1-Methyl-19-norcholesta-1,3,5(10)-trien-6-one |
| CAS Registry Number |
71472-80-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40O |
| InChI |
InChI=1S/C27H40O/c1-17(2)8-6-9-18(3)23-12-13-24-22-16-25(28)21-11-7-10-19(4)26(21)20(22)14-15-27(23,24)5/h7,10-11,17-18,20,22-24H,6,8-9,12-16H2,1-5H3/t18-,20+,22-,23-,24+,27-/m1/s1 |
| InChIKey |
BOAKFBNMDXYNMG-QGDKIDQASA-N |
| Molecular Weight |
380.616 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC(=O)c4c([C@]3(CC2)[H])c(ccc4)C)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-00w9-0669000000-4b6f527aac9b92aa1ccc |
| Source of Spectrum |
W5-1989-37872-27664 |
| Synonyms |
(17beta)-17-[(1R)-1,5-dimethylhexyl]-1-methylestra-1,3,5(10)-trien-6-one |
| Wiley ID |
1360013 |
