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(17Z)-Cholest-17-ene-3,16,22,26-tetrol
SpectraBase Compound ID 2sDxKP98HZy
InChI InChI=1S/C27H46O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16,18-24,28-31H,5-15H2,1-4H3/b25-17+
InChIKey GEBBIUNJNURARC-KOEQRZSOSA-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 BE5VmBEqe
Name (17Z)-Cholest-17-ene-3,16,22,26-tetrol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O4
InChI InChI=1S/C27H46O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16,18-24,28-31H,5-15H2,1-4H3/b25-17+
InChIKey GEBBIUNJNURARC-KOEQRZSOSA-N
Molecular Weight 434.661 g/mol
SMILES OCC(CCC(\C(=C\1C2(CCC3C4(CCC(CC4CCC3C2CC1O)O)C)C)C)O)C
SPLASH splash10-0a59-7900000000-42da7d9a3460f9de4807
Source of Spectrum NP-15-944-0
Synonyms 17-Cholesten-3,16,22,27-tetraol (17Z)-17-(3,7-dihydroxy-6-methylheptan-2-ylidene)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,16-diol (17Z)-10,13-dimethyl-17-[6-methyl-3,7-bis(oxidanyl)heptan-2-ylidene]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,16-diol
Wiley ID 1112245