Chem
J-GLOBAL ID:200907093702336633   Nikkaji number:J810.482D

4-[[[2-[[2-(1H-Imidazol-4-yl)ethyl]amino]-9H-purin-6-yl]amino]methyl]benzene-1,2-diol

4-[[[2-[[2-(1H-イミダゾール-4-イル)エチル]アミノ]-9H-プリン-6-イル]アミノ]メチル]ベンゼン-1,2-ジオール
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: C17H18N8O2
Molecular formula furigana: C17-H18-N8-O2
Molecular weight: 366.385
InChI: InChI=1S/C17H18N8O2/c26-12-2-1-10(5-13(12)27)6-20-15-14-16(23-9-22-14)25-17(24-15)19-4-3-11-7-18-8-21-11/h1-2,5,7-9,26-27H,3-4,6H2,(H,18,21)(H3,19,20,22,23,24,25)
InChI key: WOEIYSZKXFTZCL-UHFFFAOYSA-N
SMILES: Oc1ccc(CNc2nc(NCCc3c[nH]cn3)nc3[nH]cnc23)cc1O
Systematic name  (3):
  • 4-[[[2-[[2-(1H-イミダゾール-4-イル)エチル]アミノ]-9H-プリン-6-イル]アミノ]メチル]ベンゼン-1,2-ジオール
  • 4-{[(2-{[2-(1H-イミダゾール-4-イル)エチル]アミノ}-9H-プリン-6-イル)アミノ]メチル}ベンゼン-1,2-ジオール
  • 4-{[(2-{[2-(1H-imidazol-4-yl)ethyl]amino}-9H-purin-6-yl)amino]methyl}benzene-1,2-diol
Other name (1):
  • 4-[[[2-[[2-(1H-Imidazol-4-yl)ethyl]amino]-9H-purin-6-yl]amino]methyl]benzene-1,2-diol
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