Chem
J-GLOBAL ID：200907021180472107   Nikkaji number：J2.603.735B

2-(Dimethylaminomethyleneamino)-3-(4-nitrophenethyl)-6-[(1R,2S)-1-(4-methoxybenzyloxy)-2-acetoxypropyl]-3,4-dihydropteridine-4-one

2-(ジメチルアミノメチレンアミノ)-3-(4-ニトロフェネチル)-6-[(1R,2S)-1-(4-メトキシベンジルオキシ)-2-アセトキシプロピル]-3,4-ジヒドロプテリジン-4-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： C30H33N6[N+]O6[O-]
Molecular formula furigana： C30-H33-N7-O7
Molecular weight： 603.636
InChI： InChI=1S/C30H33N7O7/c1-19(44-20(2)38)27(43-17-22-8-12-24(42-5)13-9-22)25-16-31-28-26(33-25)29(39)36(30(34-28)32-18-35(3)4)15-14-21-6-10-23(11-7-21)37(40)41/h6-13,16,18-19,27H,14-15,17H2,1-5H3/t19-,27-/m0/s1
InChI key： BJRMMTJWUDKQQX-PPHZAIPVSA-N
SMILES： COc1ccc(CO[C@@H]([C@H](C)OC(=O)C)c2cnc3nc(N=CN(C)C)n(CCc4ccc(cc4)[N+](=O)[O-])c(=O)c3n2)cc1
Systematic name  (4)：
  • 2-(ジメチルアミノメチレンアミノ)-3-[2-(4-ニトロフェニル)エチル]-6-[(1R,2S)-1-(4-メトキシベンジルオキシ)-2-アセトキシプロピル]-3,4-ジヒドロプテリジン-4-オン
  • 2-(ジメチルアミノメチレンアミノ)-3-(4-ニトロフェネチル)-6-[(1R,2S)-1-(4-メトキシベンジルオキシ)-2-アセトキシプロピル]-3,4-ジヒドロプテリジン-4-オン
  • (1R,2S)-1-(2-{[(ジメチルアミノ)メチリデン]アミノ}-3-[2-(4-ニトロフェニル)エチル]-4-オキソ-3,4-ジヒドロプテリジン-6-イル)-1-[(4-メトキシフェニル)メトキシ]プロパン-2-イル アセタート
  • (1R,2S)-1-(2-{[(dimethylamino)methylidene]amino}-3-[2-(4-nitrophenyl)ethyl]-4-oxo-3,4-dihydropteridin-6-yl)-1-[(4-methoxyphenyl)methoxy]propan-2-yl acetate
Other name (2)：
  • 2-(Dimethylaminomethyleneamino)-3-[2-(4-nitrophenyl)ethyl]-6-[(1R,2S)-1-(4-methoxybenzyloxy)-2-acetoxypropyl]-3,4-dihydropteridine-4-one
  • 2-(Dimethylaminomethyleneamino)-3-(4-nitrophenethyl)-6-[(1R,2S)-1-(4-methoxybenzyloxy)-2-acetoxypropyl]-3,4-dihydropteridine-4-one
Thsaurus map：
Thesaurus Map

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