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Cholan-24-ol, 3-methoxy-, (3.beta.,5.alpha.)-
SpectraBase Compound ID Kp92ILmTgJL
InChI InChI=1S/C25H44O2/c1-17(6-5-15-26)21-9-10-22-20-8-7-18-16-19(27-4)11-13-24(18,2)23(20)12-14-25(21,22)3/h17-23,26H,5-16H2,1-4H3/t17-,18+,19+,20+,21-,22+,23+,24+,25-/m1/s1
InChIKey PDLRNZGUYZBQSK-OKLGQZCBSA-N
Mol Weight 376.6 g/mol
Molecular Formula C25H44O2
Exact Mass 376.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLabhvCVs5C
Name Cholan-24-ol, 3-methoxy-, (3.beta.,5.alpha.)-
CAS Registry Number 124512-60-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H44O2
InChI InChI=1S/C25H44O2/c1-17(6-5-15-26)21-9-10-22-20-8-7-18-16-19(27-4)11-13-24(18,2)23(20)12-14-25(21,22)3/h17-23,26H,5-16H2,1-4H3/t17-,18+,19+,20+,21-,22+,23+,24+,25-/m1/s1
InChIKey PDLRNZGUYZBQSK-OKLGQZCBSA-N
Molecular Weight 376.625 g/mol
SMILES OCCC[C@]([C@@]1([C@@]2([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC)(C4)[H])C)[H])[H])(CC1)[H])C)[H])(C)[H]
SPLASH splash10-004i-0049000000-37bba6f5e5eebe21fae8
Source of Spectrum C-112-309-19
Synonyms (3beta,5alpha)-3-methoxycholan-24-ol 3.beta.-methoxy-5.alpha.-cholan-24-ol
Wiley ID 1358073