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Pregnan-3-ol, 20-methyl-, (3.beta.,5.beta.,17.alpha.)-
SpectraBase Compound ID GKjdZukdmv4
InChI InChI=1S/C22H38O/c1-14(2)18-9-10-19-17-8-6-15-5-7-16(23)13-22(15,4)20(17)11-12-21(18,19)3/h14-20,23H,5-13H2,1-4H3/t15-,16-,17+,18+,19+,20+,21-,22+/m1/s1
InChIKey OAKRLTVUIACRHG-PAJIKSTKSA-N
Mol Weight 318.5 g/mol
Molecular Formula C22H38O
Exact Mass 318.292266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qj8DitXAtw
Name Pregnan-3-ol, 20-methyl-, (3.beta.,5.beta.,17.alpha.)-
CAS Registry Number 72691-63-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O
InChI InChI=1S/C22H38O/c1-14(2)18-9-10-19-17-8-6-15-5-7-16(23)13-22(15,4)20(17)11-12-21(18,19)3/h14-20,23H,5-13H2,1-4H3/t15-,16-,17+,18+,19+,20+,21-,22+/m1/s1
InChIKey OAKRLTVUIACRHG-PAJIKSTKSA-N
Molecular Weight 318.545 g/mol
SMILES O[C@]1(C[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CC1)[H])[H])(CC[C@]4(C(C)C)[H])[H])C)[H])C)[H]
SPLASH splash10-0159-0098000000-a469936c9d8549c91b5b
Source of Spectrum F-35-787-0
Synonyms (1S,2S,4R,7S,10R,11S,14S,15R)-2,15-dimethyl-14-(propan-2-yl)tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-4-ol 20-Methyl-5.alpha.,17.alpha.,-pregnan-2.beta.-ol
Wiley ID 1319083