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SMILES: C[C@H]([C@H](C(=O)O)O)C(=O)O.c1cc(c(cc1C(CN)O)O)O Canonical SMILES: OC(=O)[C@@H]([C@H](C(=O)O)C)O.NCC(c1ccc(c(c1)O)O)O InChI: InChI=1S/C8H11NO3.C5H8O5/c9-4-8(12)5-1-2-6(10)7(11)3-5;1-2(4(7)8)3(6)5(9)10/h1-3,8,10-12H,4,9H2;2-3,6H,1H3,(H,7,8)(H,9,10)/t;2-,3-/m.1/s1 InChIKey: PDZZSMDCBWCGRN-GEHKUQKJSA-N
CBID:132711 http://www.chembase.cn/molecule-132711.html