| SpectraBase Spectrum ID |
JbIaU9sxohE |
| Name |
6-Aza-A-nor-B,B-dihomo-5.alpha.-cholestan-7-one |
| Alternate Name(s) |
(1R,3aS,3bS,7aS,10aR,10bS,12aR)-1-[(1R)-1,5-dimethylhexyl]-10a,12a-dimethylhexadecahydrocyclopenta[b]indeno[5,4-d]azocin-6(1H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H47NO |
| InChI |
InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)21-12-13-22-20-11-14-25(29)28-24-10-7-16-27(24,5)23(20)15-17-26(21,22)4/h18-24H,6-17H2,1-5H3,(H,28,29)/t19-,20+,21-,22+,23+,24+,26-,27-/m1/s1 |
| InChIKey |
LABSDSTWBWMTNF-HVPCJGPWSA-N |
| Molecular Weight |
401.679 g/mol |
| SMILES |
N1C(CC[C@]2([C@]3([C@](CC[C@@]2([C@@]2([C@@]1(CCC2)[H])C)[H])([C@](CC3)([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H])=O |
| SPLASH |
splash10-066r-9100000000-b78d2ed6b770404359b1 |
| Source of Spectrum |
KC-1982-937-0 |
| Wiley ID |
1370085 |
