Chem
J-GLOBAL ID：200907019892079890   Nikkaji number：J1.402.091H

(1S,4α,5β,8R)-1,8-Dimethyl-3-oxo-2-oxabicyclo[2.2.2]octane-5-carboxylic acid

(1S,4α,5β,8R)-1,8-ジメチル-3-オキソ-2-オキサビシクロ[2.2.2]オクタン-5-カルボン酸
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： C10H14O4
Molecular formula furigana： C10-H14-O4
Molecular weight： 198.218
InChI： InChI=1S/C10H14O4/c1-5-3-10(2)4-6(8(11)12)7(5)9(13)14-10/h5-7H,3-4H2,1-2H3,(H,11,12)/t5-,6+,7-,10+/m1/s1
InChI key： DJUIGZFTQIACEK-LGVNZDMBSA-N
SMILES： C[C@@H]1C[C@@]2(C)C[C@@H]([C@@H]1C(=O)O2)C(=O)O
Systematic name  (3)：
  • (1S,4α,5β,8R)-1,8-ジメチル-3-オキソ-2-オキサビシクロ[2.2.2]オクタン-5-カルボン酸
  • (1S,4R,5S,8R)-1,8-ジメチル-3-オキソ-2-オキサビシクロ[2.2.2]オクタン-5-カルボン酸
  • (1S,4R,5S,8R)-1,8-dimethyl-3-oxo-2-oxabicyclo[2.2.2]octane-5-carboxylic acid
Other name (2)：
  • (1S,4α,5β,8R)-1,8-Dimethyl-3-oxo-2-oxabicyclo[2.2.2]octane-5-carboxylic acid
  • (1S,4R,5S,8R)-1,8-Dimethyl-3-oxo-2-oxabicyclo[2.2.2]octane-5-carboxylic acid
Thsaurus map：
Thesaurus Map

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