| SpectraBase Spectrum ID |
EmrmommTchk |
| Name |
5.ALPHA.-ANDROSTAN-3.BETA.-OL-11,17-DIONE |
| CAS Registry Number |
7090-90-6 |
| Copyright |
Copyright © 2011-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
304.203844759 u |
| Formula |
C19H28O3 |
| InChI |
InChI=1S/C19H28O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-14,17,20H,3-10H2,1-2H3/t11-,12-,13-,14-,17+,18-,19-/m0/s1 |
| InChIKey |
IUNYGQONJQTULL-LMCNQGNMSA-N |
| Molecular Weight |
304.430 g/mol |
| Nominal Mass |
304 u |
| Number of Peaks |
87 |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(C(C[C@@]4(C(CC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])=O)C)=O)[H])C)[H] |
| SPLASH |
splash10-0v03-8913000000-aaacdecae6b96f73bbb5 |
| Source File Reference |
LMCM-78545-151P |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
3-HYDROXYANDROSTANE-11,17-DIONE
(3S,5S,8S,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyldodecahydro-1H-cyclopenta[a]phenanthrene-11,17(2H,9H)-dione |
| Wiley ID |
4_930 |
