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25-homo-24-ketocholesterol
SpectraBase Compound ID FyrIeUFNPuk
InChI InChI=1S/C28H46O2/c1-6-18(2)26(30)12-7-19(3)23-10-11-24-22-9-8-20-17-21(29)13-15-27(20,4)25(22)14-16-28(23,24)5/h8,18-19,21-25,29H,6-7,9-17H2,1-5H3/t18?,19-,21?,22+,23-,24+,25+,27+,28-/m1/s1
InChIKey YBQUZQJZIPJMNS-OAMYMERGSA-N
Mol Weight 414.7 g/mol
Molecular Formula C28H46O2
Exact Mass 414.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bXAjTTMI4
Name 25-homo-24-ketocholesterol
Alternate Name(s) (7R)-7-[(1S,2R,10S,11S,14R,15R)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl]-3-methyloctan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H46O2
InChI InChI=1S/C28H46O2/c1-6-18(2)26(30)12-7-19(3)23-10-11-24-22-9-8-20-17-21(29)13-15-27(20,4)25(22)14-16-28(23,24)5/h8,18-19,21-25,29H,6-7,9-17H2,1-5H3/t18?,19-,21?,22+,23-,24+,25+,27+,28-/m1/s1
InChIKey YBQUZQJZIPJMNS-OAMYMERGSA-N
Molecular Weight 414.674 g/mol
SMILES OC1CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CCC(=O)C(CC)C)(C)[H])[H])[H])C)[H])C
SPLASH splash10-0a4i-7932100000-8d6a304ee5907a568f43
Source of Spectrum SD-1992-0-0
Wiley ID 161300