Chem
J-GLOBAL ID：200907028856115692   Nikkaji number：J1.995.857D

Tetrakis(p-toluenesulfonic acid)5,11,17,23-tetrakis(2-hydroxyethyl)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-25,26,27,28-tetryl ester

テトラキス(p-トルエンスルホン酸)5,11,17,23-テトラキス(2-ヒドロキシエチル)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,26,27,28-テトライル
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： C64H64O16S4
Molecular formula furigana： C64-H64-O16-S4
Molecular weight： 1217.440
InChI： InChI=1S/C64H64O16S4/c1-41-5-13-57(14-6-41)81(69,70)77-61-49-29-45(21-25-65)30-50(61)38-52-32-47(23-27-67)34-54(63(52)79-83(73,74)59-17-9-43(3)10-18-59)40-56-36-48(24-28-68)35-55(64(56)80-84(75,76)60-19-11-44(4)12-20-60)39-53-33-46(22-26-66)31-51(37-49)62(53)78-82(71,72)58-15-7-42(2)8-16-58/h5-20,29-36,65-68H,21-28,37-40H2,1-4H3
InChI key： PNJKNHZKRVGIQE-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)S(=O)(=O)Oc1c2Cc3cc(CCO)cc(Cc4cc(CCO)cc(Cc5cc(CCO)cc(Cc1cc(CCO)c2)c5OS(=O)(=O)c1ccc(C)cc1)c4OS(=O)(=O)c1ccc(C)cc1)c3OS(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • テトラキス(p-トルエンスルホン酸)5,11,17,23-テトラキス(2-ヒドロキシエチル)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,26,27,28-テトライル
  • 5,11,17,23-テトラキス(2-ヒドロキシエチル)-26,27,28-トリス[(4-メチルベンゼンスルホニル)オキシ]ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25-イル 4-メチルベンゼン-1-スルホナート
  • 5,11,17,23-tetrakis(2-hydroxyethyl)-26,27,28-tris[(4-methylbenzenesulfonyl)oxy]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaen-25-yl 4-methylbenzene-1-sulfonate
Other name (1)：
  • Tetrakis(p-toluenesulfonic acid)5,11,17,23-tetrakis(2-hydroxyethyl)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-25,26,27,28-tetryl ester
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