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

View entire compound with spectra: 1 MS (GC)

(3R,7S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-vinyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
SpectraBase Compound ID L5ZMhGmFhPs
InChI InChI=1S/C21H32O2/c1-4-13-5-6-16-19-17(8-10-20(13,16)2)21(3)9-7-15(22)11-14(21)12-18(19)23/h4,12-13,15-19,22-23H,1,5-11H2,2-3H3/t13-,15+,16-,17-,18+,19-,20+,21-/m0/s1
InChIKey ZIYIFFNKVNNMTR-GTCNJVPGSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n9Moyt4v3R
Name (3R,7S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-vinyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-4-13-5-6-16-19-17(8-10-20(13,16)2)21(3)9-7-15(22)11-14(21)12-18(19)23/h4,12-13,15-19,22-23H,1,5-11H2,2-3H3/t13-,15+,16-,17-,18+,19-,20+,21-/m0/s1
InChIKey ZIYIFFNKVNNMTR-GTCNJVPGSA-N
Molecular Weight 316.485 g/mol
SMILES O[C@@]1(C=C2[C@](CC[C@](C2)(O)[H])([C@]2(CC[C@@]3([C@](CC[C@]3([C@]12[H])[H])(C=C)[H])C)[H])C)[H]
SPLASH splash10-0002-3490000000-adafc7f20b12e597f3d0
Source of Spectrum G4-60-576-0
Synonyms (3R,7S,8S,9S,10R,13R,14S,17R)-17-ethenyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Wiley ID 1606723