Chem
J-GLOBAL ID：200907095457201827   Nikkaji number：J806.475J

(5Z)-2-(2,4,5-Trimethoxy-3-methylbenzyl)-3-oxo-4-benzyl-5-[(6-benzyloxy-7-methyl-1,3-benzodioxol-5-yl)methylene]-6-hydroxy-1-piperazinecarboxylic acid isopropyl ester

(5Z)-2-(2,4,5-トリメトキシ-3-メチルベンジル)-3-オキソ-4-ベンジル-5-[(6-ベンジルオキシ-7-メチル-1,3-ベンゾジオキソール-5-イル)メチレン]-6-ヒドロキシ-1-ピペラジンカルボン酸イソプロピル
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： C42H46N2O10
Molecular formula furigana： C42-H46-N2-O10
Molecular weight： 738.834
InChI： InChI=1S/C42H46N2O10/c1-25(2)54-42(47)44-33(19-30-20-34(48-5)38(50-7)26(3)36(30)49-6)40(45)43(22-28-14-10-8-11-15-28)32(41(44)46)18-31-21-35-39(53-24-52-35)27(4)37(31)51-23-29-16-12-9-13-17-29/h8-18,20-21,25,33,41,46H,19,22-24H2,1-7H3/b32-18-
InChI key： ZAHHISPDODLZBO-CAQPMQTCSA-N
SMILES： COc1cc(CC2N(C(O)/C(=C/c3cc4OCOc4c(C)c3OCc3ccccc3)/N(Cc3ccccc3)C2=O)C(=O)OC(C)C)c(OC)c(C)c1OC
Systematic name  (3)：
  • (5Z)-2-(2,4,5-トリメトキシ-3-メチルベンジル)-3-オキソ-4-ベンジル-5-[(6-ベンジルオキシ-7-メチル-1,3-ベンゾジオキソール-5-イル)メチレン]-6-ヒドロキシ-1-ピペラジンカルボン酸イソプロピル
  • プロパン-2-イル (3Z)-4-ベンジル-3-{[6-(ベンジルオキシ)-7-メチル-2H-1,3-ベンゾジオキソール-5-イル]メチリデン}-2-ヒドロキシ-5-オキソ-6-[(2,4,5-トリメトキシ-3-メチルフェニル)メチル]ピペラジン-1-カルボキシラート
  • propan-2-yl (3Z)-4-benzyl-3-{[6-(benzyloxy)-7-methyl-2H-1,3-benzodioxol-5-yl]methylidene}-2-hydroxy-5-oxo-6-[(2,4,5-trimethoxy-3-methylphenyl)methyl]piperazine-1-carboxylate
Other name (1)：
  • (5Z)-2-(2,4,5-Trimethoxy-3-methylbenzyl)-3-oxo-4-benzyl-5-[(6-benzyloxy-7-methyl-1,3-benzodioxol-5-yl)methylene]-6-hydroxy-1-piperazinecarboxylic acid isopropyl ester
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