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(20R,22R)-Cholest-5-ene-3.beta.,20,22,25-tetraol
SpectraBase Compound ID HsiiCVYerK7
InChI InChI=1S/C27H46O4/c1-24(2,30)13-12-23(29)27(5,31)22-9-8-20-19-7-6-17-16-18(28)10-14-25(17,3)21(19)11-15-26(20,22)4/h6,18-23,28-31H,7-16H2,1-5H3/t18-,19-,20-,21-,22-,23+,25-,26-,27+/m0/s1
InChIKey HDHGZWAZSSDHDI-NYKABTNVSA-N
Mol Weight 434.7 g/mol
Molecular Formula C27H46O4
Exact Mass 434.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3uX1KGaLMlg
Name (20R,22R)-Cholest-5-ene-3.beta.,20,22,25-tetraol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O4
InChI InChI=1S/C27H46O4/c1-24(2,30)13-12-23(29)27(5,31)22-9-8-20-19-7-6-17-16-18(28)10-14-25(17,3)21(19)11-15-26(20,22)4/h6,18-23,28-31H,7-16H2,1-5H3/t18-,19-,20-,21-,22-,23+,25-,26-,27+/m0/s1
InChIKey HDHGZWAZSSDHDI-NYKABTNVSA-N
Molecular Weight 434.661 g/mol
SMILES O[C@]1(CC[C@]2(C(=CC[C@]3([C@]4([C@@]([C@@]([C@]([C@@](CCC(O)(C)C)(O)[H])(O)C)(CC4)[H])(CC[C@]23[H])C)[H])[H])C1)C)[H]
SPLASH splash10-014m-9368000000-ce4afa0d74a569dabb9f
Source of Spectrum F-47-3763-6
Synonyms (3beta,22R)-cholest-5-ene-3,20,22,25-tetrol
Wiley ID 1383090