Chem
J-GLOBAL ID：200907018122250217
Nikkaji number：J721.832J
Calix(6)arene-p-sulfonate
カリックス[6]アレーン-p-スルホン酸
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： C42H36O24S6
Molecular formula furigana： C42-H36-O24-S6
Molecular weight： 1117.090
InChI：
InChI=1S/C42H36O24S6/c43-37-19-1-20-8-32(68(52,53)54)10-22(38(20)44)3-24-12-34(70(58,59)60)14-26(40(24)46)5-28-16-36(72(64,65)66)18-30(42(28)48)6-29-17-35(71(61,62)63)15-27(41(29)47)4-25-13-33(69(55,56)57)11-23(39(25)45)2-21(37)9-31(7-19)67(49,50)51/h7-18,43-48H,1-6H2,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)
InChI key：
BXOUPTJVBGEDIR-UHFFFAOYSA-N
SMILES：
Oc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc6cc(cc(Cc7cc(cc(Cc1cc(c2)S(=O)(=O)O)c7O)S(=O)(=O)O)c6O)S(=O)(=O)O)c5O)S(=O)(=O)O)c4O)S(=O)(=O)O)c3O)S(=O)(=O)O
Systematic name (6)：
- 37,38,39,40,41,42-ヘキサヒドロキシヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-5,11,17,23,29,35-ヘキサスルホン酸
- 37,38,39,40,41,42-ヘキサヒドロキシヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-5,11,17,23,29,35-ヘキサキス(スルホン酸)
- 37,38,39,40,41,42-ヘキサヒドロキシ-5,11,17,23,29,35-ヘキサスルホヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン
- 2,6′-メチレン-2′,6′′-メチレン-2′′,6′′′-メチレン-2′′′,6′′′′-メチレン-2′′′′,6′′′′′-メチレン-2′′′′′,6-メチレンヘキサキス[4-(ヒドロキシスルホニル)フェノール]
- 37,38,39,40,41,42-ヘキサヒドロキシヘプタシクロ[31.3.1.13,7.19,13.115,19.121,25.127,31]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-5,11,17,23,29,35-ヘキサキススルホン酸
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- カリクス[6]アレン-p-ヘキサスルホナート
- Calix[6]arene-p-hexasulfonate
- 37,38,39,40,41,42-Hexahydroxyheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene-5,11,17,23,29,35-hexasulfonic acid
- カリックス[6]アレーン-p-スルホン酸
- Calix[6]arene-p-sulfonate
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