Chem
J-GLOBAL ID:200907050418383256   Nikkaji number:J1.865.902F

2,4-Dicaffeoyl-D-altraric acid

2,4-ジカフェオイル-D-アルトラル酸
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: C24H22O14
Molecular formula furigana: C24-H22-O14
Molecular weight: 534.426
InChI: InChI=1S/C24H22O14/c25-13-5-1-11(9-15(13)27)3-7-17(29)37-21(20(32)23(33)34)19(31)22(24(35)36)38-18(30)8-4-12-2-6-14(26)16(28)10-12/h1-10,19-22,25-28,31-32H,(H,33,34)(H,35,36)/t19-,20+,21+,22+/m1/s1
InChI key: ZQGMKFHEDFDRLZ-MLNNCEHLSA-N
SMILES: O[C@H]([C@H](OC(=O)C=Cc1ccc(O)c(O)c1)[C@H](O)C(=O)O)[C@H](OC(=O)C=Cc1ccc(O)c(O)c1)C(=O)O
Systematic name  (3):
  • (2S,3R,4S,5S)-2,4-ビス[3-(3,4-ジヒドロキシフェニル)プロペノイルオキシ]-3,5-ジヒドロキシヘキサン二酸
  • (2S,3R,4S,5S)-2,4-ビス({[3-(3,4-ジヒドロキシフェニル)プロパ-2-エノイル]オキシ})-3,5-ジヒドロキシヘキサン二酸
  • (2S,3R,4S,5S)-2,4-bis({[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})-3,5-dihydroxyhexanedioic acid
Other name (3):
  • (2S,3R,4S,5S)-2,4-Bis[3-(3,4-dihydroxyphenyl)propenoyloxy]-3,5-dihydroxyhexanedioic acid
  • 2,4-ジカフェオイル-D-アルトラル酸
  • 2,4-Dicaffeoyl-D-altraric acid
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