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SMILES: CCc1c2/C=C/3\C(=C(C(=N3)/C(=C\3/[C@H]([C@@H](C(=N3)/C=c\3/c(c(/c(=C/c(c1C)[nH]2)/[nH]3)C=C)C)C)CCC(=O)O)/CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C Canonical SMILES: CCc1c2/C=C\3/N=C(C(=C3C)C(=O)O)/C(=C/3\N=C(/C=c/4\[nH]/c(=C\c(c1C)[nH]2)/c(C=C)c4C)[C@H]([C@@H]3CCC(=O)O)C)/CC(=O)N[C@H](C(=O)O)CC(=O)O InChI: InChI=1S/C38H41N5O9/c1-7-20-16(3)24-12-26-18(5)22(9-10-32(45)46)35(42-26)23(11-31(44)41-30(37(49)50)15-33(47)48)36-34(38(51)52)19(6)27(43-36)14-29-21(8-2)17(4)25(40-29)13-28(20)39-24/h7,12-14,18,22,30,39-40H,1,8-11,15H2,2-6H3,(H,41,44)(H,45,46)(H,47,48)(H,49,50)(H,51,52)/b24-12-,25-13-,26-12-,27-14+,28-13-,29-14-,35-23-,36-23+/t18-,22-,30-/m0/s1 InChIKey: SIEXFRDYNDREBM-GPOMGCKDSA-N
CBID:130448 http://www.chembase.cn/molecule-130448.html