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28,33-Dinorgorgosta-5,7-dien-3-ol, (3.beta.,22R)-
SpectraBase Compound ID DwmSWInyxAU
InChI InChI=1S/C28H44O/c1-17(2)14-19-15-23(19)18(3)24-8-9-25-22-7-6-20-16-21(29)10-12-27(20,4)26(22)11-13-28(24,25)5/h6-7,17-19,21,23-26,29H,8-16H2,1-5H3/t18-,19-,21+,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey WKCGCGRGKHBRNB-FRNQZOCISA-N
Mol Weight 396.7 g/mol
Molecular Formula C28H44O
Exact Mass 396.339216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DURBNDOWP5y
Name 28,33-Dinorgorgosta-5,7-dien-3-ol, (3.beta.,22R)-
CAS Registry Number 85733-77-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44O
InChI InChI=1S/C28H44O/c1-17(2)14-19-15-23(19)18(3)24-8-9-25-22-7-6-20-16-21(29)10-12-27(20,4)26(22)11-13-28(24,25)5/h6-7,17-19,21,23-26,29H,8-16H2,1-5H3/t18-,19-,21+,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey WKCGCGRGKHBRNB-FRNQZOCISA-N
Molecular Weight 396.659 g/mol
SMILES O[C@@]1(CC2=CC=C3[C@]4([C@]([C@]([C@@]([C@]5([C@](CC(C)C)(C5)[H])[H])(C)[H])([H])CC4)(C)CC[C@@]3([C@]2(CC1)C)[H])[H])[H]
SPLASH splash10-01ot-0019000000-90b42b8a703371d69ae4
Source of Spectrum KC-1983-152-0
Synonyms (22R,23R)-22,23-methylenecholesta-5,7-dien-3.beta.-ol (22R,23R)-22,23-methylenecholesta-5,7-dien-3b-ol (3beta,20R)-20-[(1R,2R)-2-isobutylcyclopropyl]pregna-5,7-dien-3-ol
Wiley ID 1367792