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

*Links on SpectraBase are not permalinks.
26,27-Dinorcholest-22-ene, 3-methoxy-24-(2-methylpropyl)-, (3.beta.,5.alpha.,22E,24S)-
SpectraBase Compound ID ACrWJox6ADA
InChI InChI=1S/C30H52O/c1-20(2)18-21(3)8-9-22(4)26-12-13-27-25-11-10-23-19-24(31-7)14-16-29(23,5)28(25)15-17-30(26,27)6/h8-9,20-28H,10-19H2,1-7H3/b9-8+/t21-,22-,23+,24+,25+,26-,27+,28+,29+,30-/m1/s1
InChIKey RTTURYPKKBWIMJ-UXFKRJMUSA-N
Mol Weight 428.7 g/mol
Molecular Formula C30H52O
Exact Mass 428.401816 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 GOHW5Lztl3s
Name 26,27-Dinorcholest-22-ene, 3-methoxy-24-(2-methylpropyl)-, (3.beta.,5.alpha.,22E,24S)-
CAS Registry Number 124512-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O
InChI InChI=1S/C30H52O/c1-20(2)18-21(3)8-9-22(4)26-12-13-27-25-11-10-23-19-24(31-7)14-16-29(23,5)28(25)15-17-30(26,27)6/h8-9,20-28H,10-19H2,1-7H3/b9-8+/t21-,22-,23+,24+,25+,26-,27+,28+,29+,30-/m1/s1
InChIKey RTTURYPKKBWIMJ-UXFKRJMUSA-N
Molecular Weight 428.745 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](\C=C\[C@](CC(C)C)(C)[H])(C)[H])[H])[H])C
SPLASH splash10-004i-0022900000-7200297704efbe95745c
Source of Spectrum C-112-308-9
Synonyms (1S,2S,5S,7S,10R,11S,14R,15R)-14-[(2R,3E,5S)-5,7-dimethyloct-3-en-2-yl]-5-methoxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane (22E,24S)-3.beta.-methoxy-24-methyl-26,26-dimethyl-27-nor-5.alpha.cholest-22-ene
Wiley ID 1381031