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(22E,20R)-cholesta-5,22-diene-3.alpha.,21-diol
SpectraBase Compound ID BOeCwXPWN8V
InChI InChI=1S/C27H44O2/c1-18(2)6-5-7-19(17-28)23-10-11-24-22-9-8-20-16-21(29)12-14-26(20,3)25(22)13-15-27(23,24)4/h5,7-8,18-19,21-25,28-29H,6,9-17H2,1-4H3/b7-5+/t19-,21+,22-,23+,24-,25-,26-,27+/m0/s1
InChIKey WXYDMHVQGVIZNA-DLBMBFGUSA-N
Mol Weight 400.6 g/mol
Molecular Formula C27H44O2
Exact Mass 400.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FULLN6xohKV
Name (22E,20R)-cholesta-5,22-diene-3.alpha.,21-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O2
InChI InChI=1S/C27H44O2/c1-18(2)6-5-7-19(17-28)23-10-11-24-22-9-8-20-16-21(29)12-14-26(20,3)25(22)13-15-27(23,24)4/h5,7-8,18-19,21-25,28-29H,6,9-17H2,1-4H3/b7-5+/t19-,21+,22-,23+,24-,25-,26-,27+/m0/s1
InChIKey WXYDMHVQGVIZNA-DLBMBFGUSA-N
Molecular Weight 400.647 g/mol
SMILES O[C@@]1(CC[C@]2(C(=CC[C@]3([C@]4([C@@]([C@@]([C@](CO)(\C=C\CC(C)C)[H])(CC4)[H])(CC[C@]23[H])C)[H])[H])C1)C)[H]
SPLASH splash10-00di-0092000000-74da7b8097864ebd7ea9
Source of Spectrum F-41-6046-6
Synonyms (3alpha,22E)-cholesta-5,22-diene-3,21-diol
Wiley ID 1369720