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(1S,3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-6-oxidanyl-hept-4-yn-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

Compound with spectra: 1 MS (GC)

(1S,3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-6-oxidanyl-hept-4-yn-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
SpectraBase Compound ID HLkFZ9N7CZg
InChI InChI=1S/C27H42O3/c1-17(7-6-13-25(2,3)30)21-10-11-22-20-9-8-18-15-19(28)16-24(29)27(18,5)23(20)12-14-26(21,22)4/h8,17,19-24,28-30H,7,9-12,14-16H2,1-5H3/t17-,19-,20+,21-,22+,23+,24+,26-,27+/m1/s1
InChIKey SAQFWLQMCBTJEQ-FDRPCONVSA-N
Mol Weight 414.6 g/mol
Molecular Formula C27H42O3
Exact Mass 414.313395 g/mol
Enantiomer InChIKey SAQFWLQMCBTJEQ-AKBOQUKDSA-N

View Spectrum of (1S,3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-6-oxidanyl-hept-4-yn-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

MS (GC) Spectrum
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Source of Spectrum H-65-1516-0
Pregn-5-ene-1,3,21-triol, 20-methyl-, (1.alpha.,3.beta.,20S)-
27-Norcholesta-5,23-dien-25-one, 1,3-dihydroxy-, (1.alpha.,3.beta.,23E)-
Cholesta-5,23-diene-1,3,25-triol, (1.alpha.,3.beta.,23Z)-
(1S,3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R)-6-methyl-6-oxidanyl-hept-4-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
(1S,3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylhepta-4,5-dien-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
Cholest-5-ene-1,3-diol, (1.beta.,3.beta.)-
(6R)-6-[(1S,3R,8S,9S,10R,13R,14S,17R)-1,3-dihydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-heptanone
Pregn-5-ene-1,3,21-triol, 20-methyl-, 21-acetate, (1.alpha.,3.beta.,20S)-
Cholest-5-ene-1,3-diol, 25-(1-ethoxyethoxy)-, (1.alpha.,3.beta.)-
Pregn-5-ene-1,3-diol, 21-(1-methoxy-1-methylethoxy)-20-methyl-, (1.alpha.,3.beta.,20S)-
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