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Cholestane-3,11-diol
SpectraBase Compound ID GixPNbyFdJK
InChI InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)13-14-26(19,4)25(21)24(29)16-27(22,23)5/h17-25,28-29H,6-16H2,1-5H3
InChIKey YHDOHJOIKRNFGT-UHFFFAOYSA-N
Mol Weight 404.7 g/mol
Molecular Formula C27H48O2
Exact Mass 404.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nJktW5o1Wo
Name Cholestane-3,11-diol
CAS Registry Number 69454-64-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48O2
InChI InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)13-14-26(19,4)25(21)24(29)16-27(22,23)5/h17-25,28-29H,6-16H2,1-5H3
InChIKey YHDOHJOIKRNFGT-UHFFFAOYSA-N
Molecular Weight 404.679 g/mol
SMILES OC1C2C(CCC3C2(CCC(C3)O)C)C2C(C1)(C(CC2)C(CCCC(C)C)C)C
SPLASH splash10-00du-0479000000-0e38dd5027cd089e7f20
Source of Spectrum J-44-1869-0
Synonyms 10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol 17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol 5.alpha.,14.beta.-Cholestane-3.beta.,11.alpha.-diol 5.alpha.,8.alpha.,14.beta.-Cholestane-3.beta.,11.beta.-diol
Wiley ID 1371582