For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5β-Androstan-3α,11α,17β-triol
SpectraBase Compound ID BjYTlwjSqWo
InChI InChI=1S/C19H32O3/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/h11-17,20-22H,3-10H2,1-2H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+/m1/s1
InChIKey FNICIUSFFWRLFW-DMNAVFTESA-N
Mol Weight 308.5 g/mol
Molecular Formula C19H32O3
Exact Mass 308.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 391exFkntaN
Name 5.BETA.-ANDROSTANE-3.ALPHA.,11.ALPHA.,17.BETA.-TRIOL
CAS Registry Number 32212-61-6
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 308.235144887 u
Formula C19H32O3
InChI InChI=1S/C19H32O3/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/h11-17,20-22H,3-10H2,1-2H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+/m1/s1
InChIKey FNICIUSFFWRLFW-DMNAVFTESA-N
Molecular Weight 308.462 g/mol
Nominal Mass 308 u
Number of Peaks 63
SMILES O[C@@]1([C@]2(C[C@]([C@@]3([C@]4(CC[C@](C[C@]4(CC[C@]3([C@@]2(CC1)[H])[H])[H])(O)[H])C)[H])(O)[H])C)[H]
SPLASH splash10-00di-1590000000-0cc8486977537db7c0f3
Source File Reference LMCM-81171-576Q
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 5.BETA.-ANDROSTAN-3.ALPHA.,11.ALPHA.,17.BETA.-TRIOL ANDROSTANE-3,11,17-TRIOL (3R,5R,8S,9S,10S,11R,13S,14S,17S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,11,17-triol
Wiley ID 4_821