Chem
J-GLOBAL ID：200907037356832206   Nikkaji number：J1.820.448G

1,1′,10,10′-[3,3-Bis[3-[1,1-bis[2-(tert-butoxycarbonyl)ethyl]-3-(tert-butoxycarbonyl)propylcarbamoyl]propoxycarbonyl]-1,1,2,2-cyclopropanetetryl]-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′-[3,3-ビス[3-[1,1-ビス[2-(tert-ブトキシカルボニル)エチル]-3-(tert-ブトキシカルボニル)プロピルカルバモイル]プロポキシカルボニル]-1,1,2,2-シクロプロパンテトライル]-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： C115H92N2O18
Molecular formula furigana： C115-H92-N2-O18
Molecular weight： 1789.997
InChI： InChI=1S/C115H92N2O18/c1-105(2,3)130-39(120)23-29-111(30-24-40(121)131-106(4,5)6,31-25-41(122)132-107(7,8)9)116-37(118)21-19-35-128-103(126)115(104(127)129-36-20-22-38(119)117-112(32-26-42(123)133-108(10,11)12,33-27-43(124)134-109(13,14)15)34-28-44(125)135-110(16,17)18)113-99-91-83-73-63-55-47-45-46-49-53-51(47)59-67-61(53)71-65-57(49)58-50(46)54-52-48(45)56(55)64-70-60(52)68-62(54)72-66(58)76-75(65)85-79(71)89-81(67)87(77(83)69(59)63)95(99)97(89)101-93(85)94-86(76)80(72)90-82(68)88-78(70)84(74(64)73)92(91)100(113)96(88)98(90)102(94)114(101,113)115/h19-36H2,1-18H3,(H,116,118)(H,117,119)
InChI key： RIAZIVHCNUOFDT-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)CCC(CCC(=O)OC(C)(C)C)(CCC(=O)OC(C)(C)C)NC(=O)CCCOC(=O)C1(C(=O)OCCCC(=O)NC(CCC(=O)OC(C)(C)C)(CCC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C)C23c4c5c6c7c8c9c(c%10c%11c2c2c4c4c%12c5c5c6c6c8c8c%13c9c9c%10c%10c%11c%11c2c2c4c4c%12c%12c5c5c6c8c6c8c%13c9c9c%10c%10c%11c2c2c4c4c%12c5c6c5c8c9c%10c2c45)C137
Systematic name  (3)：
  • 1,1′,10,10′-[3,3-ビス[3-[1,1-ビス[2-(tert-ブトキシカルボニル)エチル]-3-(tert-ブトキシカルボニル)プロピルカルバモイル]プロポキシカルボニル]-1,1,2,2-シクロプロパンテトライル]-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
  • 1,7-ジ-tert-ブチル 4-(4-{61-[(3-{[1,7-ビス(tert-ブトキシ)-4-[3-(tert-ブトキシ)-3-オキソプロピル]-1,7-ジオキソヘプタン-4-イル]カルバモイル}プロポキシ)カルボニル]ドトリアコンタシクロ[16.12.30.18,39.02,34.03,36.04,29.05,38.06,28.07,25.08,39.09,24.010,21.011,40.012,20.013,42.014,44.015,19.016,46.017,49.022,60.023,58.026,57.027,55.030,54.031,53.032,47.033,45.035,43.037,41.048,52.050,59.051,56]ヘンヘキサコンタ-1,3,5,7(25),9(24),10,12,14,16(46),17(49),18,20,22,26,28,30(54),31(53),32(47),33,35,37,40,42,44,48(52),50,55,57,59-ノナコサエン-61-カルボニルオキシ}ブタンアミド)-4-[3-(tert-ブトキシ)-3-オキソプロピル]ヘプタンジオアート
  • 1,7-di-tert-butyl 4-(4-{61-[(3-{[1,7-bis(tert-butoxy)-4-[3-(tert-butoxy)-3-oxopropyl]-1,7-dioxoheptan-4-yl]carbamoyl}propoxy)carbonyl]dotriacontacyclo[16.12.30.18,39.02,34.03,36.04,29.05,38.06,28.07,25.08,39.09,24.010,21.011,40.012,20.013,42.014,44.015,19.016,46.017,49.022,60.023,58.026,57.027,55.030,54.031,53.032,47.033,45.035,43.037,41.048,52.050,59.051,56]henhexaconta-1,3,5,7(25),9(24),10,12,14,16(46),17(49),18,20,22,26,28,30(54),31(53),32(47),33,35,37,40,42,44,48(52),50,55,57,59-nonacosaene-61-carbonyloxy}butanamido)-4-[3-(tert-butoxy)-3-oxopropyl]heptanedioate
Other name (1)：
  • 1,1′,10,10′-[3,3-Bis[3-[1,1-bis[2-(tert-butoxycarbonyl)ethyl]-3-(tert-butoxycarbonyl)propylcarbamoyl]propoxycarbonyl]-1,1,2,2-cyclopropanetetryl]-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
Thsaurus map：
Thesaurus Map

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