Chem
J-GLOBAL ID:200907094450783409   Nikkaji number:J1.107.429D

2-[[4-[[(2,4-Diaminopteridine-6-yl)methyl]amino]benzoyl]amino]pentanedioic acid

2-[[4-[[(2,4-ジアミノプテリジン-6-イル)メチル]アミノ]ベンゾイル]アミノ]ペンタン二酸
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: C19H20N8O5
Molecular formula furigana: C19-H20-N8-O5
Molecular weight: 440.420
InChI: InChI=1S/C19H20N8O5/c20-15-14-16(27-19(21)26-15)23-8-11(24-14)7-22-10-3-1-9(2-4-10)17(30)25-12(18(31)32)5-6-13(28)29/h1-4,8,12,22H,5-7H2,(H,25,30)(H,28,29)(H,31,32)(H4,20,21,23,26,27)
InChI key: TVZGACDUOSZQKY-UHFFFAOYSA-N
SMILES: Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O)cnc2n1
Systematic name  (3):
  • 2-[[4-[[(2,4-ジアミノプテリジン-6-イル)メチル]アミノ]ベンゾイル]アミノ]ペンタン二酸
  • 2-[(4-{[(2,4-ジアミノプテリジン-6-イル)メチル]アミノ}フェニル)ホルムアミド]ペンタン二酸
  • 2-[(4-{[(2,4-diaminopteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid
Other name (1):
  • 2-[[4-[[(2,4-Diaminopteridine-6-yl)methyl]amino]benzoyl]amino]pentanedioic acid
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