Chem
J-GLOBAL ID:200907048637905948   Nikkaji number:J1.671.417H

(E)-2β-[6-[(E)-2-Carboxyvinyl]-3,4-dihydroxyphenyl]-3α-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-acrylic acid

(E)-2β-[6-[(E)-2-カルボキシビニル]-3,4-ジヒドロキシフェニル]-3α-(3,4-ジヒドロキシフェニル)-2,3-ジヒドロ-1,4-ベンゾジオキシン-6-アクリル酸
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: C26H20O10
Molecular formula furigana: C26-H20-O10
Molecular weight: 492.436
InChI: InChI=1S/C26H20O10/c27-17-5-3-15(11-18(17)28)25-26(16-12-20(30)19(29)10-14(16)4-8-24(33)34)35-21-6-1-13(2-7-23(31)32)9-22(21)36-25/h1-12,25-30H,(H,31,32)(H,33,34)/b7-2+,8-4+/t25-,26-/m0/s1
InChI key: WFTAMGQMDYYYJX-PPNJNYSUSA-N
SMILES: OC(=O)/C=C/c1ccc2O[C@H]([C@@H](Oc2c1)c1ccc(O)c(O)c1)c1cc(O)c(O)cc1/C=C/C(=O)O
Systematic name  (3):
  • (E)-2β-[6-[(E)-2-カルボキシビニル]-3,4-ジヒドロキシフェニル]-3α-(3,4-ジヒドロキシフェニル)-2,3-ジヒドロ-1,4-ベンゾジオキシン-6-アクリル酸
  • (2E)-3-[(2S,3S)-2-{2-[(1E)-2-カルボキシエタ-1-エン-1-イル]-4,5-ジヒドロキシフェニル}-3-(3,4-ジヒドロキシフェニル)-2,3-ジヒドロ-1,4-ベンゾジオキシン-6-イル]プロパ-2-エン酸
  • (2E)-3-[(2S,3S)-2-{2-[(1E)-2-carboxyeth-1-en-1-yl]-4,5-dihydroxyphenyl}-3-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enoic acid
Other name (1):
  • (E)-2β-[6-[(E)-2-Carboxyvinyl]-3,4-dihydroxyphenyl]-3α-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-acrylic acid
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