Chem
J-GLOBAL ID：200907042621178274   Nikkaji number：J10.073K

Pteroic acid

プテロイン酸
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： C14H12N6O3
Molecular formula furigana： C14-H12-N6-O3
Molecular weight： 312.289
InChI： InChI=1S/C14H12N6O3/c15-14-19-11-10(12(21)20-14)18-9(6-17-11)5-16-8-3-1-7(2-4-8)13(22)23/h1-4,6,16H,5H2,(H,22,23)(H3,15,17,19,20,21)
InChI key： JOAQINSXLLMRCV-UHFFFAOYSA-N
SMILES： Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)O)cnc2[nH]1
Systematic name  (5)：
  • 4-[[(2-アミノ-1,4-ジヒドロ-4-オキソプテリジン-6-イル)メチル]アミノ]安息香酸
  • 4-[(2-アミノ-4-ヒドロキシプテリジン-6-イル)メチルアミノ]安息香酸
  • 4-[[(4-オキソ-3,4-ジヒドロ-2-アミノプテリジン-6-イル)メチル]アミノ]安息香酸
  • 4-{[(2-アミノ-4-オキソ-1,4-ジヒドロプテリジン-6-イル)メチル]アミノ}安息香酸
  • 4-{[(2-amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}benzoic acid
Other name (5)：
  • プテロイン酸
  • Pteroic acid
  • 4-[[(2-Amino-1,4-dihydro-4-oxopteridin-6-yl)methyl]amino]benzoic acid
  • 4-[(2-Amino-4-hydroxypteridine-6-yl)methylamino]benzoic acid
  • 4-[[(4-Oxo-3,4-dihydro-2-aminopteridine-6-yl)methyl]amino]benzoic acid
CAS registry number： 119-24-4
KEGG COMPOUND： C07582
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