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SMILES: CC(C)SC1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O[Na])O)O)O Canonical SMILES: [Na]OC(=O)[C@H]1OC(SC(C)C)[C@@H]([C@H]([C@@H]1O)O)O InChI: InChI=1S/C9H16O6S.Na/c1-3(2)16-9-6(12)4(10)5(11)7(15-9)8(13)14;/h3-7,9-12H,1-2H3,(H,13,14);/q;+1/p-1/t4-,5-,6+,7-,9?;/m0./s1 InChIKey: KBUAMHFDNNUCET-JYYOLFTLSA-M
CBID:154051 http://www.chembase.cn/molecule-154051.html