Chem
J-GLOBAL ID：200907020783749220   Nikkaji number：J1.213.384G

1-(2-Amino-2-carboxyethyl)thymine

1-(2-アミノ-2-カルボキシエチル)チミン
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： C8H11N3O4
Molecular formula furigana： C8-H11-N3-O4
Molecular weight： 213.193
InChI： InChI=1S/C8H11N3O4/c1-4-2-11(3-5(9)7(13)14)8(15)10-6(4)12/h2,5H,3,9H2,1H3,(H,13,14)(H,10,12,15)
InChI key： KTGLMWSHVYJUSQ-UHFFFAOYSA-N
SMILES： Cc1cn(CC(N)C(=O)O)c(=O)[nH]c1=O
Systematic name  (4)：
  • α-アミノ-2,4-ジオキソ-5-メチル-3,4-ジヒドロピリミジン-1(2H)-プロピオン酸
  • 1-(2-アミノ-2-カルボキシエチル)チミン
  • 2-アミノ-3-(5-メチル-2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)プロパン酸
  • 2-amino-3-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)propanoic acid
Other name (2)：
  • α-Amino-2,4-dioxo-5-methyl-3,4-dihydropyrimidine-1(2H)-propionic acid
  • 1-(2-Amino-2-carboxyethyl)thymine
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