Chem
J-GLOBAL ID：200907006438980855   Nikkaji number：J1.330.867E

Sinapoyl malate

シナポイルマラート
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： C15H16O9
Molecular formula furigana： C15-H16-O9
Molecular weight： 340.284
InChI： InChI=1S/C15H16O9/c1-22-9-5-8(6-10(23-2)14(9)19)3-4-13(18)24-11(15(20)21)7-12(16)17/h3-6,11,19H,7H2,1-2H3,(H,16,17)(H,20,21)
InChI key： DUDGAPSRYCQPBG-UHFFFAOYSA-N
SMILES： COc1cc(C=CC(=O)OC(CC(=O)O)C(=O)O)cc(OC)c1O
Systematic name  (4)：
  • 2-[3-(3,5-ジメトキシ-4-ヒドロキシフェニル)アクリロイルオキシ]こはく酸
  • 2-[3-(3,5-ジメトキシ-4-ヒドロキシフェニル)プロペノイルオキシ]ブタン二酸
  • 2-{[3-(4-ヒドロキシ-3,5-ジメトキシフェニル)プロパ-2-エノイル]オキシ}ブタン二酸
  • 2-{[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}butanedioic acid
Other name (4)：
  • 2-[3-(3,5-Dimethoxy-4-hydroxyphenyl)acryloyloxy]succinic acid
  • 2-[3-(3,5-Dimethoxy-4-hydroxyphenyl)propenoyloxy]butanedioic acid
  • シナポイルマラート
  • Sinapoyl malate
KEGG COMPOUND： C02897
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