| SpectraBase Spectrum ID |
6JrXTkRQCcI |
| Name |
5a-Aza-5a-homocholest-4-en-6-one |
| Alternate Name(s) |
(1R,3aS,3bS,10aR,10bS,12aR)-1-[(1R)-1,5-dimethylhexyl]-10a,12a-dimethyl-2,3,3a,3b,4,6,8,9,10,10a,10b,11,12,12a-tetradecahydroindeno[4,5-d][1]benzazepin-5(1H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H45NO |
| InChI |
InChI=1S/C27H45NO/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25(29)28-24-11-6-7-15-27(24,5)23(20)14-16-26(21,22)4/h11,18-23H,6-10,12-17H2,1-5H3,(H,28,29)/t19-,20+,21-,22+,23+,26-,27-/m1/s1 |
| InChIKey |
SXZUBDQJERSSJL-VHHOZFFRSA-N |
| Molecular Weight |
399.663 g/mol |
| SMILES |
N1C=2[C@@]([C@]3(CC[C@]4([C@]([C@@]3(CC1=O)[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCCC2)C |
| SPLASH |
splash10-0002-0209200000-060b5f0186fd21bed4f7 |
| Source of Spectrum |
KC-0-3249-52 |
| Wiley ID |
782641 |
