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SMILES: C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)/C(=N/OC)/c1nc(sc1)N)C(=O)O)Cn1ccc(=N)n1CCO.S(=O)(=O)(O)O Canonical SMILES: OS(=O)(=O)O.OCCn1c(=N)ccn1CC1=C(C(=O)O)N2[C@H](SC1)[C@@H](C2=O)NC(=O)/C(=N/OC)/c1csc(n1)N InChI: InChI=1S/C19H22N8O6S2.H2O4S/c1-33-24-12(10-8-35-19(21)22-10)15(29)23-13-16(30)27-14(18(31)32)9(7-34-17(13)27)6-25-3-2-11(20)26(25)4-5-28;1-5(2,3)4/h2-3,8,13,17,20,28H,4-7H2,1H3,(H2,21,22)(H,23,29)(H,31,32);(H2,1,2,3,4)/b20-11?,24-12+;/t13-,17-;/m1./s1 InChIKey: LZOLCSVRFKCSEM-VIPNVKMVSA-N
CBID:72644 http://www.chembase.cn/molecule-72644.html