Chem
J-GLOBAL ID:200907049551533866   Nikkaji number:J1.680.096A

2′′-Isobutyl-2′,3-dibenzyl-4-(carboxymethoxy)-1,1′:4′,1′′-terbenzene-4′′-propionic acid

2′′-イソブチル-2′,3-ジベンジル-4-(カルボキシメトキシ)-1,1′:4′,1′′-テルベンゼン-4′′-プロピオン酸
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: C41H40O5
Molecular formula furigana: C41-H40-O5
Molecular weight: 612.766
InChI: InChI=1S/C41H40O5/c1-28(2)21-34-23-31(14-20-40(42)43)13-17-37(34)32-15-18-38(35(25-32)22-29-9-5-3-6-10-29)33-16-19-39(46-27-41(44)45)36(26-33)24-30-11-7-4-8-12-30/h3-13,15-19,23,25-26,28H,14,20-22,24,27H2,1-2H3,(H,42,43)(H,44,45)
InChI key: FJHSPDMWUOLOQG-UHFFFAOYSA-N
SMILES: CC(C)Cc1cc(CCC(=O)O)ccc1c1ccc(c(Cc2ccccc2)c1)c1ccc(OCC(=O)O)c(Cc2ccccc2)c1
Systematic name  (4):
  • 2-イソブチル-3′,3′′-ジベンジル-4′′-(2-ヒドロキシ-2-オキソエトキシ)-1,1′:4′,1′′-テルベンゼン-4-プロピオン酸
  • 2′′-イソブチル-2′,3-ジベンジル-4-(カルボキシメトキシ)-1,1′:4′,1′′-テルベンゼン-4′′-プロピオン酸
  • 3-{4-[2,3'-ジベンジル-4'-(カルボキシメトキシ)-[1,1'-ビフェニル]-4-イル]-3-(2-メチルプロピル)フェニル}プロパン酸
  • 3-{4-[2,3'-dibenzyl-4'-(carboxymethoxy)-[1,1'-biphenyl]-4-yl]-3-(2-methylpropyl)phenyl}propanoic acid
Other name (2):
  • 2-Isobutyl-3′,3′′-dibenzyl-4′′-(2-hydroxy-2-oxoethoxy)-1,1′:4′,1′′-terbenzene-4-propionic acid
  • 2′′-Isobutyl-2′,3-dibenzyl-4-(carboxymethoxy)-1,1′:4′,1′′-terbenzene-4′′-propionic acid
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