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

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-(1-methylethenyl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID E4HDxLYo3mt
InChI InChI=1S/C22H34O/c1-14(2)18-7-8-19-17-6-5-15-13-16(23)9-11-21(15,3)20(17)10-12-22(18,19)4/h5,16-20,23H,1,6-13H2,2-4H3/t16-,17-,18+,19-,20-,21-,22+/m0/s1
InChIKey JRWLCFVPJFFOTJ-BIBIXIOVSA-N
Mol Weight 314.5 g/mol
Molecular Formula C22H34O
Exact Mass 314.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtuxpewNJw2
Name (3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-(1-methylethenyl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
CAS Registry Number 17879-91-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O
InChI InChI=1S/C22H34O/c1-14(2)18-7-8-19-17-6-5-15-13-16(23)9-11-21(15,3)20(17)10-12-22(18,19)4/h5,16-20,23H,1,6-13H2,2-4H3/t16-,17-,18+,19-,20-,21-,22+/m0/s1
InChIKey JRWLCFVPJFFOTJ-BIBIXIOVSA-N
Molecular Weight 314.513 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4(C(=C)C)[H])[H])C)[H])C)[H]
SPLASH splash10-03di-0039000000-af5ff87baddb28045d08
Source of Spectrum F-35-787-0
Synonyms (3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-prop-1-en-2-yl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,8S,9S,10R,13S,14S,17R)-17-isopropenyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID 1315690