| SpectraBase Spectrum ID |
KOMFV17G8Ye |
| Name |
7-Aza-B-homocholest-5-en-7a-one |
| Alternate Name(s) |
Benz[c]indeno[5,4-e]azepine, 7-aza-B-homocholest-5-en-7a-one deriv.
(1R,3aS,3bS,10aR,10bS,12aR)-1-[(1R)-1,5-dimethylhexyl]-10a,12a-dimethyl-2,3,3a,3b,5,7,8,9,10,10a,10b,11,12,12a-tetradecahydroindeno[4,5-d][2]benzazepin-4(1H)-one
7a-aza-b-homocholest-5-en-7-one |
| CAS Registry Number |
107612-02-2 |
| 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)21-12-13-22-24-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-28-25(24)29/h17-19,21-24H,6-16H2,1-5H3,(H,28,29)/t19-,21-,22+,23+,24+,26+,27-/m1/s1 |
| InChIKey |
FTKRSIHHUWCFNR-VQPMOVACSA-N |
| Molecular Weight |
399.663 g/mol |
| SMILES |
N1C=C2[C@@]([C@]3(CC[C@]4([C@]([C@@]3(C1=O)[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCCC2)C |
| SPLASH |
splash10-00fs-0598200000-f7a5e47e1a29f8ed3446 |
| Source of Spectrum |
KC-1988-326-15 |
| Wiley ID |
1369133 |
