Chem
J-GLOBAL ID：200907003672210126   Nikkaji number：J1.985.987H

(1R,3aα,6aα)-1,5-Diphenyl-3β-(2-pyrrolizino-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1β-carboxylic acid methyl ester

(1R,3aα,6aα)-1,5-ジフェニル-3β-(2-ピロリジノ-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル)-4,6-ジオキソオクタヒドロピロロ[3,4-c]ピロール-1β-カルボン酸メチル
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： C32H29N5O5
Molecular formula furigana： C32-H29-N5-O5
Molecular weight： 563.614
InChI： InChI=1S/C32H29N5O5/c1-42-31(41)32(20-12-4-2-5-13-20)25-23(29(39)37(30(25)40)21-14-6-3-7-15-21)26(34-32)24-27(35-17-10-11-18-35)33-22-16-8-9-19-36(22)28(24)38/h2-9,12-16,19,23,25-26,34H,10-11,17-18H2,1H3/t23-,25-,26+,32-/m0/s1
InChI key： OZOMLACHPFIGIY-PIVZZMFTSA-N
SMILES： COC(=O)[C@]1(N[C@H]([C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)c1c(nc2ccccn2c1=O)N1CCCC1)c1ccccc1
Systematic name  (4)：
  • (1R,3aα,6aα)-1,5-ジフェニル-3β-(2-ピロリジノ-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル)-4,6-ジオキソオクタヒドロピロロ[3,4-c]ピロール-1β-カルボン酸メチル
  • (1R,3aα,6aα)-1,5-ジフェニル-3β-[2-ピロリジノ-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]-4,6-ジオキソオクタヒドロピロロ[3,4-c]ピロール-1β-カルボン酸メチル
  • メチル (1R,3R,3aS,6aR)-4,6-ジオキソ-3-[4-オキソ-2-(ピロリジン-1-イル)-4H-ピリド[1,2-a]ピリミジン-3-イル]-1,5-ジフェニル-オクタヒドロピロロ[3,4-c]ピロール-1-カルボキシラート
  • methyl (1R,3R,3aS,6aR)-4,6-dioxo-3-[4-oxo-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]-1,5-diphenyl-octahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Other name (2)：
  • (1R,3aα,6aα)-1,5-Diphenyl-3β-(2-pyrrolizino-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1β-carboxylic acid methyl ester
  • (1R,3aα,6aα)-1,5-Diphenyl-3β-[2-pyrrolizino-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1β-carboxylic acid methyl ester
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