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(20R,22S,25RS)-27-Propyl-1-cholest-5-ene-3.beta.,20,22,25-tetraol
SpectraBase Compound ID DcyQmvoPMI4
InChI InChI=1S/C30H52O4/c1-6-7-15-27(2,33)16-14-26(32)30(5,34)25-11-10-23-22-9-8-20-19-21(31)12-17-28(20,3)24(22)13-18-29(23,25)4/h8,21-26,31-34H,6-7,9-19H2,1-5H3/t21-,22-,23-,24-,25-,26?,27?,28-,29-,30+/m0/s1
InChIKey HQYWUZAVLDFDLR-RADKLNOXSA-N
Mol Weight 476.7 g/mol
Molecular Formula C30H52O4
Exact Mass 476.38656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SuKttHDjrQ
Name (20R,22S,25RS)-27-Propyl-1-cholest-5-ene-3.beta.,20,22,25-tetraol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O4
InChI InChI=1S/C30H52O4/c1-6-7-15-27(2,33)16-14-26(32)30(5,34)25-11-10-23-22-9-8-20-19-21(31)12-17-28(20,3)24(22)13-18-29(23,25)4/h8,21-26,31-34H,6-7,9-19H2,1-5H3/t21-,22-,23-,24-,25-,26?,27?,28-,29-,30+/m0/s1
InChIKey HQYWUZAVLDFDLR-RADKLNOXSA-N
Molecular Weight 476.742 g/mol
SMILES O[C@]1(CC[C@]2(C(=CC[C@]3([C@]4([C@@]([C@@]([C@](C(CCC(O)(CCCC)C)O)(O)C)(CC4)[H])(CC[C@]23[H])C)[H])[H])C1)C)[H]
SPLASH splash10-00kg-9088000000-25d0785d0d498deaadac
Source of Spectrum F-47-3763-5
Synonyms (2R)-2-[(1S,2R,5S,10S,11S,14S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl]-6-methyldecane-2,3,6-triol
Wiley ID 1394433