SpectraBase Spectrum ID |
HlK07lyVO2K |
Name |
5.ALPHA.-ANDROSTAN-16.ALPHA.-OL-17-ONE |
CAS Registry Number |
25846-17-7 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
290.224580204 u |
Formula |
C19H30O2 |
InChI |
InChI=1S/C19H30O2/c1-18-9-4-3-5-12(18)6-7-13-14(18)8-10-19(2)15(13)11-16(20)17(19)21/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,18+,19+/m1/s1 |
InChIKey |
BHZXMBDTBMXJAX-ZLOBMTTQSA-N |
Molecular Weight |
290.447 g/mol |
Nominal Mass |
290 u |
Number of Peaks |
72 |
SMILES |
O[C@@]1(C[C@]2([C@@]3(CC[C@]4(CCCC[C@@]4([C@]3(CC[C@@]2(C1=O)C)[H])C)[H])[H])[H])[H] |
SPLASH |
splash10-014i-6590000000-b861060d08ce284b00d4 |
Source File Reference |
LMCM-72976-682P |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
16-HYDROXYANDROSTAN-17-ONE
(5R,8R,9S,10S,13S,14S,16R)-16-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one |
Wiley ID |
4_1127 |