| SpectraBase Spectrum ID |
6ogSvSaDpH2 |
| Name |
5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL-7-ONE-3.ALPHA.,17.BETA.-DI-ACETATE |
| CAS Registry Number |
49644-19-1 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
390.240624190 u |
| Formula |
C23H34O5 |
| InChI |
InChI=1S/C23H34O5/c1-13(24)27-16-7-9-22(3)15(11-16)12-19(26)21-17-5-6-20(28-14(2)25)23(17,4)10-8-18(21)22/h15-18,20-21H,5-12H2,1-4H3/t15-,16-,17+,18+,20+,21+,22+,23+/m1/s1 |
| InChIKey |
ICLVBZVECAGRBZ-ZZCAJEDESA-N |
| Molecular Weight |
390.520 g/mol |
| Nominal Mass |
390 u |
| Number of Peaks |
150 |
| SMILES |
[C@@]1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(C(C[C@]2(C1)[H])=O)[H])[H])(OC(C)=O)[H])C)[H])C)(OC(C)=O)[H] |
| SPLASH |
splash10-001r-3396000000-4642b7b7b4601c86731a |
| Source File Reference |
LMCM-37445-688V |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
17-(ACETYLOXY)-7-OXOANDROSTAN-3-YL ACETATE
(3R,5R,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthrene-3,17-diyl diacetate |
| Wiley ID |
4_2751 |
