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SMILES: c1c(nc[nH]1)C[C@@H](C(=O)O)NC(=O)CN.O.Cl Canonical SMILES: NCC(=O)N[C@H](C(=O)O)Cc1c[nH]cn1.O.Cl InChI: InChI=1S/C8H12N4O3.ClH.H2O/c9-2-7(13)12-6(8(14)15)1-5-3-10-4-11-5;;/h3-4,6H,1-2,9H2,(H,10,11)(H,12,13)(H,14,15);1H;1H2/t6-;;/m0../s1 InChIKey: VGVLXWZHJBRECR-ILKKLZGPSA-N
CBID:152333 http://www.chembase.cn/molecule-152333.html