SpectraBase Spectrum ID |
4UN6HRaJ16 |
Name |
5.ALPHA.-ANDROSTANE-3.BETA.,16.ALPHA.,17.BETA.-TRIOL |
CAS Registry Number |
19316-59-7 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
308.235144887 u |
Formula |
C19H32O3 |
InChI |
InChI=1S/C19H32O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h11-17,20-22H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16+,17-,18-,19-/m0/s1 |
InChIKey |
CXGDRQWRJUSSAR-CJZYGSATSA-N |
Molecular Weight |
308.462 g/mol |
Nominal Mass |
308 u |
Number of Peaks |
126 |
SMILES |
O[C@]1([C@@]([C@]2(CC[C@@]3([C@]4(CC[C@@](C[C@@]4(CC[C@]3([C@@]2(C1)[H])[H])[H])(O)[H])C)[H])C)(O)[H])[H] |
SPLASH |
splash10-05nf-1290000000-d0ce6fc89c6059de7119 |
Source File Reference |
LMCM-20687-926W |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
3.BETA.,16.ALPHA.,17.BETA.-TRIHYDROXY-5.ALPHA.-ANDROSTANE
ANDROSTANE-3,16,17-TRIOL
(3S,5S,8R,9S,10S,13S,14S,16R,17R)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,16,17-triol |
Wiley ID |
4_6 |