Chem
J-GLOBAL ID:200907081434182492
Nikkaji number:J2.413.377J
3β-Phenyl-2-benzyl-5β-[2-(dimethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]pyrrolidine-2β,4,4-tricarboxylic acid trimethyl ester
3β-フェニル-2-ベンジル-5β-[2-(ジメチルアミノ)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]ピロリジン-2β,4,4-トリカルボン酸トリメチル
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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:
C33 H34 N4 O7
Molecular formula furigana:
C33-H34-N4-O7
Molecular weight:
598.656
InChI:
InChI=1S/C33H34N4O7/c1-36(2)27-24(28(38)37-19-13-12-18-23(37)34-27)26-33(30(40)43-4,31(41)44-5)25(22-16-10-7-11-17-22)32(35-26,29(39)42-3)20-21-14-8-6-9-15-21/h6-19,25-26,35H,20H2,1-5H3/t25-,26-,32-/m1/s1
InChI key:
JHWMGPWIMHUDAW-ZAOJZYTHSA-N
SMILES:
COC(=O)[C@]1(Cc2ccccc2)N[C@H](c2c(nc3ccccn3c2=O)N(C)C)C([C@@H]1c1ccccc1)(C(=O)OC)C(=O)OC
Systematic name (3):
3β-フェニル-2-ベンジル-5β-[2-(ジメチルアミノ)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]ピロリジン-2β,4,4-トリカルボン酸トリメチル
2,4,4-トリメチル (2R,3S,5R)-2-ベンジル-5-[2-(ジメチルアミノ)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]-3-フェニルピロリジン-2,4,4-トリカルボキシラート
2,4,4-trimethyl (2R,3S,5R)-2-benzyl-5-[2-(dimethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-3-phenylpyrrolidine-2,4,4-tricarboxylate
Other name (1):
3β-Phenyl-2-benzyl-5β-[2-(dimethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]pyrrolidine-2β,4,4-tricarboxylic acid trimethyl ester
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