SpectraBase Spectrum ID |
1HUbfl5ouJC |
Name |
5.ALPHA.-ANDROSTANE-3.BETA.,11.ALPHA.-DIOL-17-ONE |
CAS Registry Number |
25848-75-3 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
306.219494823 u |
Formula |
C19H30O3 |
InChI |
InChI=1S/C19H30O3/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/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12-,13-,14-,15+,17+,18-,19-/m0/s1 |
InChIKey |
PIXFHVWJOVNKQK-OAZQVCGISA-N |
Molecular Weight |
306.446 g/mol |
Nominal Mass |
306 u |
Number of Peaks |
192 |
SMILES |
O[C@]1([C@@]2([C@]3(CC[C@@](C[C@@]3(CC[C@]2([C@@]2(CCC([C@]2(C1)C)=O)[H])[H])[H])(O)[H])C)[H])[H] |
SPLASH |
splash10-0a6r-7942000000-d44b4d5587d0f511683a |
Source File Reference |
LMCM-28704-145K |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
3,11-DIHYDROXYANDROSTAN-17-ONE
(3S,5S,8S,9S,10S,11R,13S,14S)-3,11-dihydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one |
Wiley ID |
4_2855 |