Chem
J-GLOBAL ID：200907090063407223   Nikkaji number：J2.071.559F

3-[(E)-3-Isobutyl-5-methylhexylidene]-5β-(pivaloyloxymethyl)-5-(hydroxymethyl)tetrahydrofuran-2-one

3-[(E)-3-イソブチル-5-メチルヘキシリデン]-5β-(ピバロイルオキシメチル)-5-(ヒドロキシメチル)テトラヒドロフラン-2-オン
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： C22H38O5
Molecular formula furigana： C22-H38-O5
Molecular weight： 382.541
InChI： InChI=1S/C22H38O5/c1-15(2)10-17(11-16(3)4)8-9-18-12-22(13-23,27-19(18)24)14-26-20(25)21(5,6)7/h9,15-17,23H,8,10-14H2,1-7H3/b18-9+/t22-/m1/s1
InChI key： XKEOGEXDEKIDNA-XROMRFNBSA-N
SMILES： CC(C)CC(C/C=C/1\C[C@@](CO)(COC(=O)C(C)(C)C)OC1=O)CC(C)C
Systematic name  (4)：
  • (R)-3-[(E)-3-イソブチル-5-メチルヘキシリデン]-5β-(ピバロイルオキシメチル)-5-(ヒドロキシメチル)テトラヒドロフラン-2-オン
  • 3-[(E)-3-イソブチル-5-メチルヘキシリデン]-5β-(ピバロイルオキシメチル)-5-(ヒドロキシメチル)テトラヒドロフラン-2-オン
  • [(2R,4E)-2-(ヒドロキシメチル)-4-[5-メチル-3-(2-メチルプロピル)ヘキシリデン]-5-オキソオキソラン-2-イル]メチル 2,2-ジメチルプロパノアート
  • [(2R,4E)-2-(hydroxymethyl)-4-[5-methyl-3-(2-methylpropyl)hexylidene]-5-oxooxolan-2-yl]methyl 2,2-dimethylpropanoate
Other name (2)：
  • (R)-3-[(E)-3-Isobutyl-5-methylhexylidene]-5β-(pivaloyloxymethyl)-5-(hydroxymethyl)tetrahydrofuran-2-one
  • 3-[(E)-3-Isobutyl-5-methylhexylidene]-5β-(pivaloyloxymethyl)-5-(hydroxymethyl)tetrahydrofuran-2-one
Thsaurus map：
Thesaurus Map

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