| SpectraBase Spectrum ID |
FYjo7Wn97bp |
| Name |
A-homo-4-seco-6-nitro-4-methyl-4-azacholestan-3-one |
| Alternate Name(s) |
3-{(3R,3aR,6R,7S)-3-[(1R)-1,5-dimethylhexyl]-3a,6-dimethyl-7-nitrododecahydro-1H-cyclopenta[a]naphthalen-6-yl}-N-methylpropanamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H48N2O3 |
| InChI |
InChI=1S/C27H48N2O3/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24(29(31)32)27(5,17-15-25(30)28-6)23(20)14-16-26(21,22)4/h18-24H,7-17H2,1-6H3,(H,28,30)/t19-,20?,21-,22?,23?,24+,26-,27-/m1/s1 |
| InChIKey |
QXVGGQZKFHRQEB-BTXKELRASA-N |
| Molecular Weight |
448.692 g/mol |
| SMILES |
N(C(CC[C@@]1(C2CC[C@]3(C(C2CC[C@@]1(N(=O)=O)[H])CC[C@@]3([C@@](CCCC(C)C)(C)[H])[H])C)C)=O)C |
| SPLASH |
splash10-000i-9010500000-65022b543ab29698f856 |
| Source of Spectrum |
F-53-10573-6 |
| Wiley ID |
803165 |
