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SMILES: CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)CC=C.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O Canonical SMILES: OC(=O)[C@H]([C@@H](C(=O)O)O)O.C=CCN1C[C@@H](C=C2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N(CC)CC InChI: InChI=1S/C22H27N3O.C4H6O6/c1-4-10-25-14-16(22(26)24(5-2)6-3)11-18-17-8-7-9-19-21(17)15(13-23-19)12-20(18)25;5-1(3(7)8)2(6)4(9)10/h4,7-9,11,13,16,20,23H,1,5-6,10,12,14H2,2-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t16-,20-;1-,2-/m10/s1 InChIKey: IZCAABQHJXKRFV-OWALFJHSSA-N
CBID:130707 http://www.chembase.cn/molecule-130707.html