Chem
J-GLOBAL ID：200907022581800111   Nikkaji number：J1.917.170A

Glutaric acid 1-[(2R,2′R)-2α,2′α-bis[3,4-bis(benzyloxy)phenyl]-3′β-hydroxy-5,5′,7,7′-tetrakis(benzyloxy)-4β,8′-bichroman-3β-yl] ester

グルタル酸1-[(2R,2′R)-2α,2′α-ビス[3,4-ビス(ベンジルオキシ)フェニル]-3′β-ヒドロキシ-5,5′,7,7′-テトラキス(ベンジルオキシ)-4β,8′-ビクロマン-3β-イル]
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： C91H80O15
Molecular formula furigana： C91-H80-O15
Molecular weight： 1413.626
InChI： InChI=1S/C91H80O15/c92-74-52-73-77(99-57-65-32-15-4-16-33-65)53-81(103-61-69-40-23-8-24-41-69)86(90(73)106-88(74)70-44-46-75(97-55-63-28-11-2-12-29-63)78(48-70)100-58-66-34-17-5-18-35-66)87-85-80(102-60-68-38-21-7-22-39-68)50-72(96-54-62-26-9-1-10-27-62)51-82(85)104-89(91(87)105-84(95)43-25-42-83(93)94)71-45-47-76(98-56-64-30-13-3-14-31-64)79(49-71)101-59-67-36-19-6-20-37-67/h1-24,26-41,44-51,53,74,87-89,91-92H,25,42-43,52,54-61H2,(H,93,94)/t74-,87+,88+,89+,91-/m0/s1
InChI key： LFPGKJRPOYFJJS-GJQISHGDSA-N
SMILES： O[C@H]1Cc2c(OCc3ccccc3)cc(OCc3ccccc3)c([C@@H]3[C@H](OC(=O)CCCC(=O)O)[C@H](Oc4cc(OCc5ccccc5)cc(OCc5ccccc5)c34)c3ccc(OCc4ccccc4)c(OCc4ccccc4)c3)c2O[C@@H]1c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
Systematic name  (3)：
  • グルタル酸1-[(2R,2′R)-2α,2′α-ビス[3,4-ビス(ベンジルオキシ)フェニル]-3′β-ヒドロキシ-5,5′,7,7′-テトラキス(ベンジルオキシ)-4β,8′-ビクロマン-3β-イル]
  • 5-{[(2R,3S,4R)-5,7-ビス(ベンジルオキシ)-4-[(2R,3S)-5,7-ビス(ベンジルオキシ)-2-[3,4-ビス(ベンジルオキシ)フェニル]-3-ヒドロキシ-3,4-ジヒドロ-2H-1-ベンゾピラン-8-イル]-2-[3,4-ビス(ベンジルオキシ)フェニル]-3,4-ジヒドロ-2H-1-ベンゾピラン-3-イル]オキシ}-5-オキソペンタン酸
  • 5-{[(2R,3S,4R)-5,7-bis(benzyloxy)-4-[(2R,3S)-5,7-bis(benzyloxy)-2-[3,4-bis(benzyloxy)phenyl]-3-hydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-2-[3,4-bis(benzyloxy)phenyl]-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-5-oxopentanoic acid
Other name (1)：
  • Glutaric acid 1-[(2R,2′R)-2α,2′α-bis[3,4-bis(benzyloxy)phenyl]-3′β-hydroxy-5,5′,7,7′-tetrakis(benzyloxy)-4β,8′-bichroman-3β-yl] ester
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