Chem
J-GLOBAL ID：200907092959784150   Nikkaji number：J2.339.609B

(3R,4S)-3,4,5-Trimethyl-6-hydroxy-8-oxo-4,8-dihydro-3H-2-benzopyran-7-carboxylic acid

(3R,4S)-3,4,5-トリメチル-6-ヒドロキシ-8-オキソ-4,8-ジヒドロ-3H-2-ベンゾピラン-7-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： C13H14O5
Molecular formula furigana： C13-H14-O5
Molecular weight： 250.250
InChI： InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,14H,1-3H3,(H,16,17)/t5-,7-/m1/s1
InChI key： CBGDIJWINPWWJW-IYSWYEEDSA-N
SMILES： C[C@H]1OC=C2C(=O)C(=C(O)C(=C2[C@@H]1C)C)C(=O)O
Systematic name  (3)：
  • (3R,4S)-3,4,5-トリメチル-6-ヒドロキシ-8-オキソ-4,8-ジヒドロ-3H-2-ベンゾピラン-7-カルボン酸
  • (3R,4S)-6-ヒドロキシ-3,4,5-トリメチル-8-オキソ-4,8-ジヒドロ-3H-2-ベンゾピラン-7-カルボン酸
  • (3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-4,8-dihydro-3H-2-benzopyran-7-carboxylic acid
Other name (1)：
  • (3R,4S)-3,4,5-Trimethyl-6-hydroxy-8-oxo-4,8-dihydro-3H-2-benzopyran-7-carboxylic acid
Thsaurus map：
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