Chem
J-GLOBAL ID:200907087590735491   Nikkaji number:J5.493C

Esculetin

エスクレチン
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: C9H6O4
Molecular formula furigana: C9-H6-O4
Molecular weight: 178.143
InChI: InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H
InChI key: ILEDWLMCKZNDJK-UHFFFAOYSA-N
SMILES: Oc1cc2ccc(=O)oc2cc1O
Systematic name  (5):
  • 6,7-ジヒドロキシ-α-クロメン-2-オン
  • 6,7-ジヒドロキシクマリン
  • 6,7-ジヒドロキシ-2H-1-ベンゾピラン-2-オン
  • 6,7-ジヒドロキシ-2H-クロメン-2-オン
  • 6,7-dihydroxy-2H-chromen-2-one
Other name (8):
  • エスクレチン
  • シコリゲニン
  • Esculetin
  • Cichorigenin
  • 6,7-Dihydroxy-2H-1-benzopyran-2-one
Show all
CAS registry number: 305-01-1
Regulation number (1):
  • EINECS2061615
KEGG COMPOUND: C09263
Application (1):
enzyme inhibitor
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