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5.alpha.-Cholestan-1-one, 19-hydroxy-
SpectraBase Compound ID 9T5v88pzZ9p
InChI InChI=1S/C27H46O2/c1-18(2)7-5-8-19(3)22-13-14-23-21-12-11-20-9-6-10-25(29)27(20,17-28)24(21)15-16-26(22,23)4/h18-24,28H,5-17H2,1-4H3/t19-,20-,21+,22-,23+,24+,26-,27+/m1/s1
InChIKey LCHCLPSWYAGVOQ-ORMLOLTMSA-N
Mol Weight 402.7 g/mol
Molecular Formula C27H46O2
Exact Mass 402.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QfcSgZrtru
Name 5.alpha.-Cholestan-1-one, 19-hydroxy-
CAS Registry Number 28809-71-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O2
InChI InChI=1S/C27H46O2/c1-18(2)7-5-8-19(3)22-13-14-23-21-12-11-20-9-6-10-25(29)27(20,17-28)24(21)15-16-26(22,23)4/h18-24,28H,5-17H2,1-4H3/t19-,20-,21+,22-,23+,24+,26-,27+/m1/s1
InChIKey LCHCLPSWYAGVOQ-ORMLOLTMSA-N
Molecular Weight 402.663 g/mol
SMILES OC[C@]12[C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CCCC1=O)[H])[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H]
SPLASH splash10-0udi-0003900000-319a51857d4a76428b09
Source of Spectrum O-4-374-7
Synonyms (5alpha)-19-hydroxycholestan-1-one 19-Hydroxymethyl-5.alpha.-cholestan-1-one
Wiley ID 1370652