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27-Norergosta-5,22-dien-3-ol, 25-ethyl-, (3.beta.,22E,25S)-
SpectraBase Compound ID 5eaZBYjpwz4
InChI InChI=1S/C29H48O/c1-7-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8-/t19-,20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey WXFBQEDDMBWDRL-DWLNXYCSSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JO24HDfzuNm
Name 27-Norergosta-5,22-dien-3-ol, 25-ethyl-, (3.beta.,22E,25S)-
CAS Registry Number 91279-39-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-7-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8-/t19-,20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey WXFBQEDDMBWDRL-DWLNXYCSSA-N
Molecular Weight 412.702 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/[C@]([C@@](CC)(C)[H])(C)[H])(C)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-03di-0096500000-3f738ffc6b4105a5e721
Source of Spectrum C-106-5621-0
Synonyms (1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3Z,5S,6R)-5,6-dimethyloct-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol (24S,25R)-24,26-dimethylcholesta-5,22-dien-3.beta.-ol (24S,25S)-24-methyl-26-methylenecholest-5-en-3.beta.-ol
Wiley ID 1374765