Chem
J-GLOBAL ID：200907018773178336   Nikkaji number：J373.303C

Betalamic acid

ベタラミン酸
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： C9H9NO5
Molecular formula furigana： C9-H9-N-O5
Molecular weight： 211.173
InChI： InChI=1S/C9H9NO5/c11-2-1-5-3-6(8(12)13)10-7(4-5)9(14)15/h1-3,7,10H,4H2,(H,12,13)(H,14,15)/b5-1-/t7-/m0/s1
InChI key： YQDKULBMDMPFLH-FSRBREEPSA-N
SMILES： OC(=O)[C@@H]1C/C(=C\C=O)/C=C(N1)C(=O)O
Systematic name  (3)：
  • (2S,4E)-1,2,3,4-テトラヒドロ-4-(2-オキソエチリデン)ピリジン-2,6-ジカルボン酸
  • (2S,4E)-4-(2-オキソエチリデン)-1,2,3,4-テトラヒドロピリジン-2,6-ジカルボン酸
  • (2S,4E)-4-(2-oxoethylidene)-1,2,3,4-tetrahydropyridine-2,6-dicarboxylic acid
Other name (4)：
  • ベタラミン酸
  • Betalamic acid
  • (2S,4E)-1,2,3,4-Tetrahydro-4-(2-oxoethylidene)pyridine-2,6-dicarboxylic acid
  • ベタラム酸
CAS registry number： 18766-66-0
KEGG COMPOUND： C08538
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