| SpectraBase Spectrum ID |
Bpr2z6SxjST |
| Name |
5.BETA.-ANDROSTAN-3.ALPHA.-OL-17-ONE |
| CAS Registry Number |
53-42-9 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
290.224580204 u |
| Formula |
C19H30O2 |
| InChI |
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,18+,19+/m1/s1 |
| InChIKey |
QGXBDMJGAMFCBF-BNSUEQOYSA-N |
| Molecular Weight |
290.447 g/mol |
| Nominal Mass |
290 u |
| Number of Peaks |
73 |
| SMILES |
O[C@@]1(CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CC[C@@]2(C1)[H])[H])[H])=O)C)[H])C)[H] |
| SPLASH |
splash10-0006-8590000000-f7525cad8ed8d82f29fa |
| Source File Reference |
LMCM-21210-507T |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
ANDROSTAN-17-ONE, 3-HYDROXY-, (3.ALPHA.,5.BETA.)-
3-HYDROXYANDROSTAN-17-ONE
(3R,5R,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one |
| Wiley ID |
4_1088 |
