Chem
J-GLOBAL ID：200907092424080847   Nikkaji number：J977.862D

p-tert-Butylsulfonylcalix[4]arene

p-tert-ブチルスルホニルカリックス[4]アレーン
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： C40H48O4[O-]8[S+2]4
Molecular formula furigana： C40-H48-O12-S4
Molecular weight： 849.050
InChI： InChI=1S/C40H48O12S4/c1-37(2,3)21-13-25-33(41)26(14-21)54(47,48)28-16-23(39(7,8)9)18-30(35(28)43)56(51,52)32-20-24(40(10,11)12)19-31(36(32)44)55(49,50)29-17-22(38(4,5)6)15-27(34(29)42)53(25,45)46/h13-20,41-44H,1-12H3
InChI key： BOLKLFFOYGXSKT-UHFFFAOYSA-N
SMILES： CC(C)(C)c1cc2c(O)c(c1)[S+2]([O-])([O-])c1cc(cc(c1O)[S+2]([O-])([O-])c1cc(cc(c1O)[S+2]([O-])([O-])c1cc(cc(c1O)[S+2]2([O-])[O-])C(C)(C)C)C(C)(C)C)C(C)(C)C
Systematic name  (15)：
  • 5,11,17,23-テトラ-tert-ブチル-25,26,27,28-テトラヒドロキシ-2,8,14,20-テトラチアペンタシクロ[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2,2,8,8,14,14,20,20-オクタオキシド
  • 5,11,17,23-テトラ-tert-ブチル-2,8,14,20-テトラチアペンタシクロ[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-テトラオール2,2,8,8,14,14,20,20-オクタオキシド
  • 5,11,17,23-テトラ-tert-ブチル-25,26,27,28-テトラヒドロキシ-2,8,14,20-テトラチアペンタシクロ[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-2,2,8,8,14,14,20,20-オクタオキシド
  • 5,11,17,23-テトラtert-ブチル-2,8,14,20-テトラチアペンタシクロ[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-テトラオール2,2,8,8,14,14,20,20-オクタオキシド
  • 5,11,17,23-テトラ-tert-ブチル-2,8,14,20-テトラチアペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサン-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-テトラオール2,2,8,8,14,14,20,20-オクタキスオキシド
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Other name (15)：
  • 5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrahydroxy-2,8,14,20-tetrathiapentacyclo[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-dodecaene 2,2,8,8,14,14,20,20-octaoxide
  • 5,11,17,23-Tetra-tert-butyl-2,8,14,20-tetrathiapentacyclo[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-dodecaene-25,26,27,28-tetraol 2,2,8,8,14,14,20,20-octaoxide
  • p-tert-Butylsulfonylcalix[4]arene
  • p-tert-ブチルスルホニルカリックス[4]アレーン
  • 5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrahydroxy-2,8,14,20-tetrathiapentacyclo[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-dodecaene-2,2,8,8,14,14,20,20-octaoxide
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