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(22R,23R)-3.beta.-Hydroxy-24-methyl-22,23-epoxy-5.alpha.-cholestan-6-one
SpectraBase Compound ID 2x8NpVUfhoi
InChI InChI=1S/C28H46O3/c1-15(2)16(3)25-26(31-25)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-23,25-26,29H,7-14H2,1-6H3/t16?,17-,18-,19-,20+,21-,22-,23+,25+,26+,27+,28+/m0/s1
InChIKey ZGGOEHJSTUUKQD-BBPVCARFSA-N
Mol Weight 430.7 g/mol
Molecular Formula C28H46O3
Exact Mass 430.344695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sBRqd6rg32
Name (22R,23R)-3.beta.-Hydroxy-24-methyl-22,23-epoxy-5.alpha.-cholestan-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H46O3
InChI InChI=1S/C28H46O3/c1-15(2)16(3)25-26(31-25)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-23,25-26,29H,7-14H2,1-6H3/t16?,17-,18-,19-,20+,21-,22-,23+,25+,26+,27+,28+/m0/s1
InChIKey ZGGOEHJSTUUKQD-BBPVCARFSA-N
Molecular Weight 430.673 g/mol
SMILES O[C@]1(CC[C@]2([C@](C1)(C(C[C@]1([C@@]3(CC[C@]([C@@]([C@@]4([C@@](C(C(C)C)C)(O4)[H])[H])(C)[H])([C@@]3(C)CC[C@]21[H])[H])[H])[H])=O)[H])C)[H]
SPLASH splash10-0a4i-0009100000-73d37674a619cdacba62
Source of Spectrum F-53-17048-5
Synonyms (3beta,5alpha,20S)-20-[(2R,3R)-3-(1,2-dimethylpropyl)oxiranyl]-3-hydroxypregnan-6-one
Wiley ID 804732