SpectraBase Spectrum ID |
7VtFAI8xvLw |
Name |
5.ALPHA.-ANDROSTANE-3.BETA.,7.BETA.-DIOL |
CAS Registry Number |
35494-18-9 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
292.240230268 u |
Formula |
C19H32O2 |
InChI |
InChI=1S/C19H32O2/c1-18-7-3-4-14(18)17-15(6-8-18)19(2)9-5-13(20)10-12(19)11-16(17)21/h12-17,20-21H,3-11H2,1-2H3/t12-,13+,14+,15+,16+,17+,18+,19+/m1/s1 |
InChIKey |
JULRGYHDDLIAHM-VXZRPZIYSA-N |
Molecular Weight |
292.463 g/mol |
Nominal Mass |
292 u |
Number of Peaks |
124 |
SMILES |
O[C@@]1([C@]2([C@@]3(CCC[C@]3(CC[C@@]2([C@]2(CC[C@@](C[C@@]2(C1)[H])(O)[H])C)[H])C)[H])[H])[H] |
SPLASH |
splash10-0a4j-5960000000-288c4966b51548d36cc3 |
Source File Reference |
LMCM-37866-207E |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
ANDROSTANE-3,7-DIOL
(3S,5R,7S,8S,9S,10S,13S,14S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol |
Wiley ID |
4_2364 |