Chem
J-GLOBAL ID:200907049281684492   Nikkaji number:J2.060.716E

α-[3-(1H-Imidazole-1-yl)propylamino]thymidine

α-[3-(1H-イミダゾール-1-イル)プロピルアミノ]チミジン
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: C16H23N5O5
Molecular formula furigana: C16-H23-N5-O5
Molecular weight: 365.390
InChI: InChI=1S/C16H23N5O5/c22-9-13-12(23)6-14(26-13)21-8-11(15(24)19-16(21)25)7-17-2-1-4-20-5-3-18-10-20/h3,5,8,10,12-14,17,22-23H,1-2,4,6-7,9H2,(H,19,24,25)/t12-,13+,14+/m0/s1
InChI key: DZUUBXPZUBPMNT-BFHYXJOUSA-N
SMILES: OC[C@H]1O[C@H](C[C@@H]1O)n1cc(CNCCCn2ccnc2)c(=O)[nH]c1=O
Systematic name  (3):
  • α-[3-(1H-イミダゾール-1-イル)プロピルアミノ]チミジン
  • 1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-5-({[3-(1H-イミダゾール-1-イル)プロピル]アミノ}メチル)-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-({[3-(1H-imidazol-1-yl)propyl]amino}methyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
  • α-[3-(1H-Imidazole-1-yl)propylamino]thymidine
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