Chem
J-GLOBAL ID：200907078692727028   Nikkaji number：J2.053.233E

7-Methyl-1-propargyl-3-(3-hydroxypropyl)-8-[(Z)-3-methoxystyryl]-7H-purine-2,6(1H,3H)-dione

7-メチル-1-プロパルギル-3-(3-ヒドロキシプロピル)-8-[(Z)-3-メトキシスチリル]-7H-プリン-2,6(1H,3H)-ジオン
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： C21H22N4O4
Molecular formula furigana： C21-H22-N4-O4
Molecular weight： 394.431
InChI： InChI=1S/C21H22N4O4/c1-4-11-25-20(27)18-19(24(21(25)28)12-6-13-26)22-17(23(18)2)10-9-15-7-5-8-16(14-15)29-3/h1,5,7-10,14,26H,6,11-13H2,2-3H3/b10-9-
InChI key： FWLDDFYHEQMIGG-KTKRTIGZSA-N
SMILES： COc1cccc(/C=C\c2nc3n(CCCO)c(=O)n(CC#C)c(=O)c3n2C)c1
Systematic name  (3)：
  • 7-メチル-1-プロパルギル-3-(3-ヒドロキシプロピル)-8-[(Z)-3-メトキシスチリル]-7H-プリン-2,6(1H,3H)-ジオン
  • 3-(3-ヒドロキシプロピル)-8-[(1Z)-2-(3-メトキシフェニル)エテニル]-7-メチル-1-(プロパ-2-イン-1-イル)-2,3,6,7-テトラヒドロ-1H-プリン-2,6-ジオン
  • 3-(3-hydroxypropyl)-8-[(1Z)-2-(3-methoxyphenyl)ethenyl]-7-methyl-1-(prop-2-yn-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Other name (1)：
  • 7-Methyl-1-propargyl-3-(3-hydroxypropyl)-8-[(Z)-3-methoxystyryl]-7H-purine-2,6(1H,3H)-dione
Thsaurus map：
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