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16-Epiestriol
SpectraBase Compound ID GNhyRlC2Oib
InChI InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,17+,18+/m1/s1
InChIKey PROQIPRRNZUXQM-ZMSHIADSSA-N
Mol Weight 288.39 g/mol
Molecular Formula C18H24O3
Exact Mass 288.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7yty1zGRTpl
Name (8R,9S,13S,14S,16S,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
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Formula C18H24O3
InChI InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,17+,18+/m1/s1
InChIKey PROQIPRRNZUXQM-ZMSHIADSSA-N
Molecular Weight 288.387 g/mol
SMILES Oc1ccc2c(CC[C@]3([C@]4([C@@]([C@]([C@](C4)(O)[H])(O)[H])(CC[C@]23[H])C)[H])[H])c1
SPLASH splash10-00kk-6910000000-8ce85e9e2694552dcf1e
Source of Spectrum JA-13-363-0
Synonyms 1,3,5(10)-Estratriene-3,16.alpha.,17.beta.-triol trans-estriol
Wiley ID 1536762