For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

24-Isopropyl-5.alpha.-cholest-22(Z)-en-3.beta.-ol - Acetate

View entire compound with spectra: 1 MS (GC)

24-Isopropyl-5.alpha.-cholest-22(Z)-en-3.beta.-ol - Acetate
SpectraBase Compound ID 1OA9csaD4d7
InChI InChI=1S/C32H54O2/c1-20(2)26(21(3)4)11-9-22(5)28-13-14-29-27-12-10-24-19-25(34-23(6)33)15-17-31(24,7)30(27)16-18-32(28,29)8/h9,11,20-22,24-30H,10,12-19H2,1-8H3/b11-9-/t22-,24+,25+,27+,28-,29+,30+,31+,32-/m1/s1
InChIKey ULXJNNDIVWMXQR-BWOXLHSSSA-N
Mol Weight 470.8 g/mol
Molecular Formula C32H54O2
Exact Mass 470.412381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6DiEDfsvd0A
Name 24-Isopropyl-5.alpha.-cholest-22(Z)-en-3.beta.-ol - Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H54O2
InChI InChI=1S/C32H54O2/c1-20(2)26(21(3)4)11-9-22(5)28-13-14-29-27-12-10-24-19-25(34-23(6)33)15-17-31(24,7)30(27)16-18-32(28,29)8/h9,11,20-22,24-30H,10,12-19H2,1-8H3/b11-9-/t22-,24+,25+,27+,28-,29+,30+,31+,32-/m1/s1
InChIKey ULXJNNDIVWMXQR-BWOXLHSSSA-N
Molecular Weight 470.782 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](\C=C/C(C(C)C)C(C)C)(C)[H])[H])[H])C
SPLASH splash10-066r-0089100000-e7f952785af6d7bad94c
Source of Spectrum X4-21-222-0
Synonyms (1S,2S,5S,7S,10R,11S,14R,15R)-2,15-dimethyl-14-[(2R,3Z)-6-methyl-5-(propan-2-yl)hept-3-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-yl acetate Acetic acid[(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-ylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]ester Acetic acid[(3S,5S,8R,9S,10S,13R,14S,17R)-17-[(Z,1R)-4-isopropyl-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]ester [(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-yl-hept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]ethanoate [(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-ylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetate [(3S,5S,8R,9S,10S,13R,14S,17R)-17-[(Z,1R)-4-isopropyl-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetate Acetic acid [(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-ylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-ylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,5S,8R,9S,10S,13R,14S,17R)-17-[(Z,1R)-4-isopropyl-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-6-methyl-5-propan-2-yl-hept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate
Wiley ID 1585832