Chem
J-GLOBAL ID：200907091928769220   Nikkaji number：J2.755.870D

5,6β-Epoxy-5β-cholestane

5,6β-エポキシ-5β-コレスタン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C27H46O
Molecular formula furigana： C27-H46-O
Molecular weight： 386.664
InChI： InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-11-12-22-20-17-24-27(28-24)15-7-6-14-26(27,5)23(20)13-16-25(21,22)4/h18-24H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24-,25-,26-,27-/m1/s1
InChI key： OJFSRAVBTAGBIM-NBGJRJMZSA-N
SMILES： CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H]4O[C@@]54CCCC[C@]5(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 5,6β-エポキシ-5β-コレスタン
  • (1S,2R,7S,9R,11S,12S,15R,16R)-2,16-ジメチル-15-[(2R)-6-メチルヘプタン-2-イル]-8-オキサペンタシクロ[9.7.0.02,7.07,9.012,16]オクタデカン
  • (1S,2R,7S,9R,11S,12S,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecane
Other name (2)：
  • 5,6β-Epoxy-5β-cholestane
  • 5,6beta-Epoxy-5beta-cholestane
KEGG COMPOUND： C05417
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