Chem
J-GLOBAL ID：200907044096625453   Nikkaji number：J504.512F

7-Epiblechnic acid

7-エピブレクニン酸
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： C18H14O8
Molecular formula furigana： C18-H14-O8
Molecular weight： 358.302
InChI： InChI=1S/C18H14O8/c19-10-4-2-9(7-12(10)21)16-15(18(24)25)14-8(3-6-13(22)23)1-5-11(20)17(14)26-16/h1-7,15-16,19-21H,(H,22,23)(H,24,25)/b6-3+/t15-,16+/m1/s1
InChI key： GJHXGOBGPWPCCK-DBLORFJXSA-N
SMILES： OC(=O)/C=C/c1ccc(O)c2O[C@H]([C@H](C(=O)O)c12)c1ccc(O)c(O)c1
Systematic name  (3)：
  • (2R)-4-[(E)-2-カルボキシエテニル]-2,3-ジヒドロ-7-ヒドロキシ-2β-(3,4-ジヒドロキシフェニル)ベンゾフラン-3α-カルボン酸
  • (2R,3R)-4-[(1E)-2-カルボキシエタ-1-エン-1-イル]-2-(3,4-ジヒドロキシフェニル)-7-ヒドロキシ-2,3-ジヒドロ-1-ベンゾフラン-3-カルボン酸
  • (2R,3R)-4-[(1E)-2-carboxyeth-1-en-1-yl]-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-3-carboxylic acid
Other name (5)：
  • 7-エピブレクニン酸
  • 7-Epiblechnic acid
  • (2R)-4-[(E)-2-Carboxyethenyl]-2,3-dihydro-7-hydroxy-2β-(3,4-dihydroxyphenyl)benzofuran-3α-carboxylic acid
  • 7-epi-ブレクニン酸
  • 7-epi-Blechnic acid
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