| SpectraBase Spectrum ID |
CRm1YM9xl2H |
| Name |
17-.beta.-Hydroxy-5-aza-4,5-seco-B-homoandrost-3-en-5-one Benzoate |
| Alternate Name(s) |
(5R,5aS,7aS,8S,10aS,10bS)-5-(3-butenyl)-5,7a-dimethyl-3-oxotetradecahydroindeno[5,4-c]azepin-8-yl benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H35NO3 |
| InChI |
InChI=1S/C26H35NO3/c1-4-5-16-26(3)21-15-17-25(2)20(19(21)11-14-23(28)27-26)12-13-22(25)30-24(29)18-9-7-6-8-10-18/h4,6-10,19-22H,1,5,11-17H2,2-3H3,(H,27,28)/t19-,20-,21-,22-,25-,26+/m0/s1 |
| InChIKey |
KWSUWXAVOVSHIE-IRMULARKSA-N |
| Molecular Weight |
409.570 g/mol |
| SMILES |
N1C(CC[C@]2([C@]3([C@](CC[C@@]2([C@]1(CCC=C)C)[H])([C@](CC3)(OC(=O)c1ccccc1)[H])C)[H])[H])=O |
| SPLASH |
splash10-0a4i-0901000000-a222304f4585987c92c5 |
| Source of Spectrum |
J-57-4118-10 |
| Wiley ID |
1373391 |
