Chem
J-GLOBAL ID：200907081535612374   Nikkaji number：J22.285B

Furobufen

フロブフェン
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： C16H12O4
Molecular formula furigana： C16-H12-O4
Molecular weight： 268.268
InChI： InChI=1S/C16H12O4/c17-13(6-8-16(18)19)10-5-7-15-12(9-10)11-3-1-2-4-14(11)20-15/h1-5,7,9H,6,8H2,(H,18,19)
InChI key： LQVMQEYROPXMQH-UHFFFAOYSA-N
SMILES： OC(=O)CCC(=O)c1ccc2oc3ccccc3c2c1
Systematic name  (3)：
  • γ-オキソ-2-ジベンゾフランブタン酸
  • 4-{8-オキサトリシクロ[7.4.0.02,7]トリデカ-1(9),2(7),3,5,10,12-ヘキサエン-4-イル}-4-オキソブタン酸
  • 4-{8-oxatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl}-4-oxobutanoic acid
Other name (4)：
  • フロブフェン
  • Furobufen
  • AY-21367
  • γ-Oxo-2-dibenzofuranbutanoic acid
CAS registry number： 38873-55-1
Regulation number (1)：
  • HP4930000
KEGG DRUG： D04277
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