Chem
J-GLOBAL ID:200907015866631503   Nikkaji number:J1.232.540A

Octakis[3-(sodiosulfo)propoxy]calix[8]arene

オクタキス[3-(ソジオスルホ)プロポキシ]カリックス[8]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: C80H88Na8O32S8
Molecular formula furigana: C80-H88-NA8-O32-S8
Molecular weight: 2001.950
InChI: InChI=1S/C80H96O32S8.8Na/c81-113(82,83)41-9-33-105-73-57-17-1-18-58(73)50-60-20-3-22-62(75(60)107-35-11-43-115(87,88)89)52-64-24-5-26-66(77(64)109-37-13-45-117(93,94)95)54-68-28-7-30-70(79(68)111-39-15-47-119(99,100)101)56-72-32-8-31-71(80(72)112-40-16-48-120(102,103)104)55-69-29-6-27-67(78(69)110-38-14-46-118(96,97)98)53-65-25-4-23-63(76(65)108-36-12-44-116(90,91)92)51-61-21-2-19-59(49-57)74(61)106-34-10-42-114(84,85)86;;;;;;;;/h1-8,17-32H,9-16,33-56H2,(H,81,82,83)(H,84,85,86)(H,87,88,89)(H,90,91,92)(H,93,94,95)(H,96,97,98)(H,99,100,101)(H,102,103,104);;;;;;;;/q;8*+1/p-8
InChI key: XAHSVCBLUKPXIU-UHFFFAOYSA-F
SMILES: [Na]OS(=O)(=O)CCCOc1c2Cc3cccc(Cc4cccc(Cc5cccc(Cc6cccc(Cc7cccc(Cc8cccc(Cc9cccc(Cc1ccc2)c9OCCCS(=O)(=O)O[Na])c8OCCCS(=O)(=O)O[Na])c7OCCCS(=O)(=O)O[Na])c6OCCCS(=O)(=O)O[Na])c5OCCCS(=O)(=O)O[Na])c4OCCCS(=O)(=O)O[Na])c3OCCCS(=O)(=O)O[Na]
Systematic name  (7):
  • 49,50,51,52,53,54,55,56-オクタキス[3-(ソジオスルホ)プロポキシ]-ノナシクロ[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]ヘキサペンタコンタ-1(49),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27,29,31(52),33,35,37(51),39,41,43(50),45,47-テトラコサエン
  • 49,50,51,52,53,54,55,56-オクタキス[3-(ソジオオキシスルホニル)プロポキシ]ノナシクロ[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]ヘキサペンタコンタ-1(49),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27,29,31(52),33,35,37(51),39,41,43(50),45,47-テトラコサエン
  • 3,3′,3′′,3′′′,3′′′′,3′′′′′,3′′′′′′,3′′′′′′′-[ノナシクロ[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]ヘキサペンタコンタ-1(49),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27,29,31(52),33,35,37(51),39,41,43(50),45,47-テトラコサエン-49,50,51,52,53,54,55,56-オクタイルオクタオキシ]オクタキス(1-プロパンスルホン酸ナトリウム)
  • 2,6-[2-[3-(ソジオスルホ)プロポキシ]-1,3-フェニレンビス[メチレン[2-[3-(ソジオスルホ)プロポキシ]-1,3-フェニレン]メチレン[2-[3-(ソジオスルホ)プロポキシ]-1,3-フェニレン]メチレン[2-[3-(ソジオスルホ)プロポキシ]-1,3-フェニレン]メチレン]]-1-[3-(ソジオスルホ)プロポキシ]ベンゼン
  • 3,3′,3′′,3′′′,3′′′′,3′′′′′,3′′′′′′,3′′′′′′′-[[ノナシクロ[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]ヘキサペンタコンタ-1(49),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27,29,31(52),33,35,37(51),39,41,43(50),45,47-テトラコサエン-49,50,51,52,53,54,55,56-オクタイル]オクタキスオキシ]オクタキス(プロパン-1-スルホン酸ナトリウム)
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Other name (8):
  • 3,3′,3′′,3′′′,3′′′′,3′′′′′,3′′′′′′,3′′′′′′′-[[Nonacyclo[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]hexapentaconta-1(49),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27,29,31(52),33,35,37(51),39,41,43(50),45,47-tetracosene-49,50,51,52,53,54,55,56-octyl]octakisoxy]octakis(propane-1-sulfonic acid sodium) salt
  • 2,6-[2-[3-(Sodiosulfo)propoxy]-1,3-phenylenebis[methylene[2-[3-(sodiosulfo)propoxy]-1,3-phenylene]methylene[2-[3-(sodiosulfo)propoxy]-1,3-phenylene]methylene[2-[3-(sodiosulfo)propoxy]-1,3-phenylene]methylene]]-1-[3-(sodiosulfo)propoxy]benzene
  • オクタキス[3-(ソジオスルホ)プロポキシ]カリックス[8]アレーン
  • Octakis[3-(sodiosulfo)propoxy]calix[8]arene
  • 3,3′,3′′,3′′′,3′′′′,3′′′′′,3′′′′′′,3′′′′′′′-[Nonacyclo[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]hexapentaconta-1(49),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27,29,31(52),33,35,37(51),39,41,43(50),45,47-tetracosene-49,50,51,52,53,54,55,56-octyloctaoxy]octakis(1-propanesulfonic acid sodium) salt
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