Chem
J-GLOBAL ID：200907012505303839
Nikkaji number：J1.303.278E
2,2,2′,2′-[[4′,5′,6,6a-Tetrahydro-1,1′,10,10′-(1,1,2,2-ethenetetryl)-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]-4′,5′,6,6a-tetryl]bis(malonic acid diethyl) ester
2,2,2′,2′-[[4′,5′,6,6a-テトラヒドロ-1,1′,10,10′-(1,1,2,2-エテンテトライル)-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]-4′,5′,6,6a-テトライル]ビス(マロン酸ジエチル)
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
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
Molecular formula： C74H20O8
Molecular formula furigana： C74-H20-O8
Molecular weight： 1036.965
InChI：
InChI=1S/C74H20O8/c1-5-79-65(75)73(66(76)80-6-2)69-57-41-25-13-11-9-10-12-14-16-21-31-19(12)29(17(9)25)45(57)47(31)59-49-33(21)24-28(16)44-42-26(14)18(10)30-20(11)32-22-15(13)27-23-34(22)50-54-38-35(23)51(61(69)43(27)41)55-39(38)40-37(53(49)63(55)71(59,69)73)36(24)52-56(40)64(54)72-60(50)48(32)46(30)58(42)70(72,62(44)52)74(72,67(77)81-7-3)68(78)82-8-4/h5-8H2,1-4H3
InChI key：
YCZNVECWMGNXGM-UHFFFAOYSA-N
SMILES：
CCOC(=O)C1(C(=O)OCC)C23c4c5c6c2c2c7c8c9c%10c(c%11c4c4c%12c%11c%11c%10c%10c%13c%14c%15c%16c%17c%18c%19c%20c%21c%22c%23c(c%14c(c7c%23c2c2c%22c7c%20c%14c%19c%19c%17c(c%11c%10%16)c%12c%19c%10c4c5c(c7c62)c%14%10)c9%13)C2%21C(C(=O)OCC)(C(=O)OCC)C%15%182)C138
Systematic name (4)：
- 6′′,6′′a-[ビス(エトキシカルボニル)メチレン]-6′′,6′′a-ジヒドロ-1,1′,10,10′-[3,3-ビス(エトキシカルボニル)-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
- 2,2,2′,2′-[[4′,5′,6,6a-テトラヒドロ-1,1′,10,10′-(1,1,2,2-エテンテトライル)-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]-4′,5′,6,6a-テトライル]ビス(マロン酸ジエチル)
- 46,46,51,51-テトラエチル トリトリアコンタシクロ[15.13.19.99,23.13,7.115,18.124,28.02,42.04,30.08,45.010,48.011,16.019,36.020,34.021,25.026,33.027,31.032,41.035,40.037,49.038,47.039,43.045,47.113,53.00,57.05,56.06,58.012,59.014,52.022,60.023,52.029,55.044,61.050,54]ドヘキサコンタ-1(31),2,4(30),5,7,9(59),10(48),11,13,15(60),16,18,20(34),21,24,26,28,32,35,37(49),38,40,42,44(61),50(54),53(62),55,57-オクタコサエン-46,46,51,51-テトラカルボキシラート
- 46,46,51,51-tetraethyl tritriacontacyclo[15.13.19.99,23.13,7.115,18.124,28.02,42.04,30.08,45.010,48.011,16.019,36.020,34.021,25.026,33.027,31.032,41.035,40.037,49.038,47.039,43.045,47.113,53.00,57.05,56.06,58.012,59.014,52.022,60.023,52.029,55.044,61.050,54]dohexaconta-1(31),2,4(30),5,7,9(59),10(48),11,13,15(60),16,18,20(34),21,24,26,28,32,35,37(49),38,40,42,44(61),50(54),53(62),55,57-octacosaene-46,46,51,51-tetracarboxylate
- 6′′,6′′a-[Bis(ethoxycarbonyl)methylene]-6′′,6′′a-dihydro-1,1′,10,10′-[3,3-bis(ethoxycarbonyl)-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
- 2,2,2′,2′-[[4′,5′,6,6a-Tetrahydro-1,1′,10,10′-(1,1,2,2-ethenetetryl)-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]-4′,5′,6,6a-tetryl]bis(malonic acid diethyl) ester
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