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SMILES: c1cc(ccc1C(C1(CCCCC1)O)CNC)O[C@@H]1O[C@H]([C@H]([C@H](O)[C@@H]1O)O)C(=O)O.Cl Canonical SMILES: CNCC(C1(O)CCCCC1)c1ccc(cc1)O[C@@H]1O[C@@H](C(=O)O)[C@H]([C@@H]([C@@H]1O)O)O.Cl InChI: InChI=1S/C21H31NO8.ClH/c1-22-11-14(21(28)9-3-2-4-10-21)12-5-7-13(8-6-12)29-20-17(25)15(23)16(24)18(30-20)19(26)27;/h5-8,14-18,20,22-25,28H,2-4,9-11H2,1H3,(H,26,27);1H/t14?,15-,16-,17+,18-,20+;/m0./s1 InChIKey: KXBUKYNISZGJHO-MSULPLJGSA-N
CBID:167260 http://www.chembase.cn/molecule-167260.html