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SMILES: c1cc(ccc1C(=O)N[13C@@H]([13CH2][13CH2][13C](=O)[O-])[13C](=O)[O-])NCc1cnc2c(n1)c(=O)[nH]c(n2)N.[Ca+2] Canonical SMILES: [O-][13C](=O)[13CH2][13CH2][13C@@H]([13C](=O)[O-])NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(=O)[nH]c(n2)N.[Ca+2] InChI: InChI=1S/C19H19N7O6.Ca/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28;/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30);/q;+2/p-2/t12-;/m0./s1/i5+1,6+1,12+1,13+1,18+1; InChIKey: KRPUUUJWTZKSOK-UEWWCEIMSA-L
CBID:135640 http://www.chembase.cn/molecule-135640.html