| SpectraBase Spectrum ID |
BHkqECD6C6A |
| Name |
1-[(10R,13S)-3-(Dimethylamino)-10,13-dimethyl-2-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[A]phenanthren-17-yl]ethanone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.282429433 u |
| Formula |
C23H37NO2 |
| InChI |
InChI=1S/C23H37NO2/c1-14(25)17-8-9-18-16-7-6-15-12-20(24(4)5)21(26)13-23(15,3)19(16)10-11-22(17,18)2/h6,16-21,26H,7-13H2,1-5H3/t16?,17?,18?,19?,20?,21?,22-,23+/m1/s1 |
| InChIKey |
ARNLHXDQNOMBKB-DLTIEYRGSA-N |
| Molecular Weight |
359.554 g/mol |
| SMILES |
[C@@]12(C(CC(C(C2)O)N(C)C)=CCC2C3CCC([C@]3(CCC12)C)C(=O)C)C |
![1-[(10R,13S)-3-(dimethylamino)-10,13-dimethyl-2-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone](/api/spectrum/BHkqECD6C6A/structure.png?h=300&w=458 "1-[(10R,13S)-3-(dimethylamino)-10,13-dimethyl-2-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone")
