| SpectraBase Spectrum ID |
BB5x97BZcJH |
| Name |
5.ALPHA.-ANDROSTANE-3.BETA.,6.ALPHA.-DIOL-11-ONE-3.BETA.,6.ALPHA.-DI-ACETATE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
390.240624190 u |
| Formula |
C23H34O5 |
| InChI |
InChI=1S/C23H34O5/c1-13(24)27-15-7-9-23(4)18(10-15)20(28-14(2)25)11-16-17-6-5-8-22(17,3)12-19(26)21(16)23/h15-18,20-21H,5-12H2,1-4H3/t15-,16-,17-,18+,20-,21+,22-,23-/m0/s1 |
| InChIKey |
CQCSXBXIIIZKCD-PZLACAJNSA-N |
| Molecular Weight |
390.520 g/mol |
| Nominal Mass |
390 u |
| Number of Peaks |
149 |
| SMILES |
[C@]1(CC[C@@]2([C@]3(C(C[C@@]4(CCC[C@]4([C@@]3(C[C@@]([C@]2(C1)[H])(OC(C)=O)[H])[H])[H])C)=O)[H])C)(OC(C)=O)[H] |
| SPLASH |
splash10-00di-6793000000-44dc2dc2747ef1122c83 |
| Source File Reference |
LMCM-76016-898T |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
3-(ACETYLOXY)-11-OXOANDROSTAN-6-YL ACETATE
(3S,5S,6S,8S,9S,10S,13S,14S)-10,13-dimethyl-11-oxohexadecahydro-1H-cyclopenta[a]phenanthrene-3,6-diyl diacetate |
| Wiley ID |
4_2900 |
