Chem
J-GLOBAL ID：200907031042099328   Nikkaji number：J20.746B

Purpurogallin

プルプロガリン
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： C11H8O5
Molecular formula furigana： C11-H8-O5
Molecular weight： 220.180
InChI： InChI=1S/C11H8O5/c12-6-3-1-2-5-4-7(13)10(15)11(16)8(5)9(6)14/h1-4,13,15-16H,(H,12,14)
InChI key： WDGFFVCWBZVLCE-UHFFFAOYSA-N
SMILES： Oc1cc2cccc(O)c(=O)c2c(O)c1O
Systematic name  (3)：
  • 2,3,4,6-テトラヒドロキシ-5H-ベンゾシクロヘプテン-5-オン
  • 2,3,4,6-テトラヒドロキシ-5H-ベンゾ[7]アンヌレン-5-オン
  • 2,3,4,6-tetrahydroxy-5H-benzo[7]annulen-5-one
Other name (3)：
  • プルプロガリン
  • Purpurogallin
  • 2,3,4,6-Tetrahydroxy-5H-benzocyclohepten-5-one
CAS registry number： 569-77-7
Regulation number (2)：
  • EINECS2093249
  • DE8380000
KEGG COMPOUND： C09964
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