Chem
J-GLOBAL ID：200907075722427297   Nikkaji number：J404.660I

Coutaric acid

クタル酸
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： C13H12O8
Molecular formula furigana： C13-H12-O8
Molecular weight： 296.231
InChI： InChI=1S/C13H12O8/c14-8-4-1-7(2-5-8)3-6-9(15)21-11(13(19)20)10(16)12(17)18/h1-6,10-11,14,16H,(H,17,18)(H,19,20)
InChI key： INYJZRKTYXTZHP-UHFFFAOYSA-N
SMILES： OC(C(OC(=O)C=Cc1ccc(O)cc1)C(=O)O)C(=O)O
Systematic name  (3)：
  • 2-[[3-(4-ヒドロキシフェニル)-1-オキソ-2-プロペニル]オキシ]-3-ヒドロキシブタン二酸
  • 2-ヒドロキシ-3-{[3-(4-ヒドロキシフェニル)プロパ-2-エノイル]オキシ}ブタン二酸
  • 2-hydroxy-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid
Other name (6)：
  • p-クマロイル酒石酸
  • (2R,3R)-p-Coumaroyl tartaric acid
  • 2-[[3-(4-Hydroxyphenyl)-1-oxo-2-propenyl]oxy]-3-hydroxybutanedioic acid
  • クタル酸
  • Coutaric acid
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