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(6S,8S,9S,10R,11R,13S,14S)-11-hydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione

View entire compound with spectra: 1 MS (GC)

(6S,8S,9S,10R,11R,13S,14S)-11-hydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
SpectraBase Compound ID 7EHyaHXuZZB
InChI InChI=1S/C20H28O3/c1-11-8-13-14-4-5-17(23)20(14,3)10-16(22)18(13)19(2)7-6-12(21)9-15(11)19/h9,11,13-14,16,18,22H,4-8,10H2,1-3H3/t11-,13-,14-,16+,18+,19-,20-/m0/s1
InChIKey UXRVRLDXIBQCQI-OTBICVIWSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wCkiSsXoGI
Name (6S,8S,9S,10R,11R,13S,14S)-11-hydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
CAS Registry Number 71418-23-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-11-8-13-14-4-5-17(23)20(14,3)10-16(22)18(13)19(2)7-6-12(21)9-15(11)19/h9,11,13-14,16,18,22H,4-8,10H2,1-3H3/t11-,13-,14-,16+,18+,19-,20-/m0/s1
InChIKey UXRVRLDXIBQCQI-OTBICVIWSA-N
Molecular Weight 316.441 g/mol
SMILES O[C@]1([C@@]2([C@@]3(C(=CC(CC3)=O)[C@@](C)(C[C@]2([C@@]2(CCC([C@]2(C1)C)=O)[H])[H])[H])C)[H])[H]
SPLASH splash10-00kb-0096000000-584760cd67b5508e7671
Source of Spectrum I-57-1587-0
Synonyms (6S,8S,9S,10R,11R,13S,14S)-11-hydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-quinone (6S,8S,9S,10R,11R,13S,14S)-6,10,13-trimethyl-11-oxidanyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
Wiley ID 1317059