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Chem
J-GLOBAL ID：200907009365389265
Nikkaji number：J939.931C 4-Octylbenzenesulfonic acid 41-hydroxy-3,6,9,12,15,18,21,24,27,30,33,36,39-tridecaoxahentetracontan-1-yl ester
4-オクチルベンゼンスルホン酸41-ヒドロキシ-3,6,9,12,15,18,21,24,27,30,33,36,39-トリデカオキサヘンテトラコンタン-1-イル
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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： C42H78O17S
Molecular formula furigana： C42-H78-O17-S
Molecular weight： 887.130
InChI：
InChI=1S/C42H78O17S/c1-2-3-4-5-6-7-8-41-9-11-42(12-10-41)60(44,45)59-40-39-58-38-37-57-36-35-56-34-33-55-32-31-54-30-29-53-28-27-52-26-25-51-24-23-50-22-21-49-20-19-48-18-17-47-16-15-46-14-13-43/h9-12,43H,2-8,13-40H2,1H3
InChI key：
FXMGCDDHDJTFBB-UHFFFAOYSA-N
SMILES：
CCCCCCCCc1ccc(cc1)S(=O)(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
Systematic name (3)： - 4-オクチルベンゼンスルホン酸41-ヒドロキシ-3,6,9,12,15,18,21,24,27,30,33,36,39-トリデカオキサヘンテトラコンタン-1-イル
- 41-[(4-オクチルベンゼンスルホニル)オキシ]-3,6,9,12,15,18,21,24,27,30,33,36,39-トリデカオキサヘンテトラコンタン-1-オール
- 41-[(4-octylbenzenesulfonyl)oxy]-3,6,9,12,15,18,21,24,27,30,33,36,39-tridecaoxahentetracontan-1-ol
- 4-Octylbenzenesulfonic acid 41-hydroxy-3,6,9,12,15,18,21,24,27,30,33,36,39-tridecaoxahentetracontan-1-yl ester
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