Chem
J-GLOBAL ID：200907079749047661   Nikkaji number：J1.702.559G

2-Propyl-4-oxo-8-(2,6-dihydroxybenzoyl)-4H-1-benzopyran-5,7-dicarboxylic acid

8-(2,6-ジヒドロキシベンゾイル)-4-オキソ-2-プロピル-4H-クロメン-5,7-ジカルボン酸
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： C21H16O9
Molecular formula furigana： C21-H16-O9
Molecular weight： 412.350
InChI： InChI=1S/C21H16O9/c1-2-4-9-7-14(24)15-10(20(26)27)8-11(21(28)29)16(19(15)30-9)18(25)17-12(22)5-3-6-13(17)23/h3,5-8,22-23H,2,4H2,1H3,(H,26,27)(H,28,29)
InChI key： TZSGBIJXLPRMIA-UHFFFAOYSA-N
SMILES： CCCc1cc(=O)c2c(cc(C(=O)O)c(C(=O)c3c(O)cccc3O)c2o1)C(=O)O
Systematic name  (3)：
  • 2-プロピル-4-オキソ-8-(2,6-ジヒドロキシベンゾイル)-4H-1-ベンゾピラン-5,7-ジカルボン酸
  • 8-(2,6-ジヒドロキシベンゾイル)-4-オキソ-2-プロピル-4H-クロメン-5,7-ジカルボン酸
  • 8-(2,6-dihydroxybenzoyl)-4-oxo-2-propyl-4H-chromene-5,7-dicarboxylic acid
Other name (1)：
  • 2-Propyl-4-oxo-8-(2,6-dihydroxybenzoyl)-4H-1-benzopyran-5,7-dicarboxylic acid
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