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KURCHINICIN;1,4-DIEN-11-ALPHA,17-BETA-DIHYDROXY-3-OXOANDROSTANE
SpectraBase Compound ID DqafCMg3z0s
InChI InChI=1S/C19H26O3/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/h7-9,13-17,21-22H,3-6,10H2,1-2H3/t13-,14-,15+,16-,17+,18-,19-/m0/s1
InChIKey XBDIPICFPCBNBB-RUOITVIXSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4c4KAjtXhw
Name (8S,9S,10R,11R,13S,14S,17S)-10,13-dimethyl-11,17-bis(oxidanyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
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Formula C19H26O3
InChI InChI=1S/C19H26O3/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/h7-9,13-17,21-22H,3-6,10H2,1-2H3/t13-,14-,15+,16-,17+,18-,19-/m0/s1
InChIKey XBDIPICFPCBNBB-RUOITVIXSA-N
Molecular Weight 302.414 g/mol
SMILES O[C@]1([C@@]2([C@]3(C=CC(C=C3CC[C@]2([C@@]2(CC[C@@]([C@]2(C1)C)(O)[H])[H])[H])=O)C)[H])[H]
SPLASH splash10-0ff0-0915000000-c82fdd9b7dc393ff5d01
Source of Spectrum X2-57-31-1
Synonyms (8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Wiley ID 1605316