Chem
J-GLOBAL ID：200907040761931050   Nikkaji number：J2.163.669J

1,1′,10,10′-[2-[3,5-Bis(octadecyloxy)phenyl]-1-methylpyrrolidine-3,3,4,4-tetryl]-1′′,6′,7′,10′′-(1,1,2,2-ethenetetryl)-6,6′′,7,7′′-(1,1,2,2-ethenetetryl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-benzenehexyl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-terfluoranthene

1,1′,10,10′-[2-[3,5-ビス(オクタデシルオキシ)フェニル]-1-メチルピロリジン-3,3,4,4-テトライル]-1′′,6′,7′,10′′-(1,1,2,2-エテンテトライル)-6,6′′,7,7′′-(1,1,2,2-エテンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ベンゼンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テルフルオランテン
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： C105H83NO2
Molecular formula furigana： C105-H83-N-O2
Molecular weight： 1390.824
InChI： InChI=1S/C105H83NO2/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-107-43-38-42(39-44(40-43)108-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2)103-105-101-95-89-79-67-59-51-47-45-46-49-53(51)61(67)71-65-57(49)58-50(46)54-52-48(45)56-55(47)63-69(59)77-83-73(63)74-64(56)70-60(52)68-62(54)72-66(58)76-75(65)87(81(71)89)97(101)98-88(76)82(72)90-80(68)86-78(70)84(74)92-91(83)99(93(95)85(77)79)104(105,41-106(103)3)100(92)94(86)96(90)102(98)105/h38-40,103H,4-37,41H2,1-3H3
InChI key： IECKNRFEUZJYGL-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCCCCCCOc1cc(OCCCCCCCCCCCCCCCCCC)cc(c1)C1N(C)CC23c4c5c6c2c2c7c8c9c%10c(c%11c4c4c%12c%11c%11c%10c%10c%13c9c9c7c7c2c2c6c6c%14c5c4c4c%14c5c%14c6c2c2c7c6c9c%13c7c9c%10c%11c%10c%12c4c4c%10c9c9c7c6c2c%14c9c54)C138
Systematic name  (3)：
  • 1,1′,10,10′-[2-[3,5-ビス(オクタデシルオキシ)フェニル]-1-メチルピロリジン-3,3,4,4-テトライル]-1′′,6′,7′,10′′-(1,1,2,2-エテンテトライル)-6,6′′,7,7′′-(1,1,2,2-エテンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ベンゼンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テルフルオランテン
  • 20-[3,5-ビス(オクタデシルオキシ)フェニル]-21-メチル-21-アザドトリアコンタシクロ[8.7.46.02,6.03,27.04,34.05,61.07,63.08,17.09,14.011,57.012,55.013,49.015,48.016,19.018,26.019,23.023,47.024,45.025,29.028,33.030,44.031,42.032,36.035,60.037,41.038,59.039,56.040,53.043,52.046,51.050,54.058,62]トリヘキサコンタ-1(17),2(6),3(27),4(34),5(61),7,9(14),10,12(55),13(49),15,18(26),24,28,30(44),31(42),32,35,37,39(56),40,43(52),45,47,50,53,57,59,62-ノナコサエン
  • 20-[3,5-bis(octadecyloxy)phenyl]-21-methyl-21-azadotriacontacyclo[8.7.46.02,6.03,27.04,34.05,61.07,63.08,17.09,14.011,57.012,55.013,49.015,48.016,19.018,26.019,23.023,47.024,45.025,29.028,33.030,44.031,42.032,36.035,60.037,41.038,59.039,56.040,53.043,52.046,51.050,54.058,62]trihexaconta-1(17),2(6),3(27),4(34),5(61),7,9(14),10,12(55),13(49),15,18(26),24,28,30(44),31(42),32,35,37,39(56),40,43(52),45,47,50,53,57,59,62-nonacosaene
Other name (1)：
  • 1,1′,10,10′-[2-[3,5-Bis(octadecyloxy)phenyl]-1-methylpyrrolidine-3,3,4,4-tetryl]-1′′,6′,7′,10′′-(1,1,2,2-ethenetetryl)-6,6′′,7,7′′-(1,1,2,2-ethenetetryl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-benzenehexyl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-terfluoranthene
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