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SMILES: c1c(nc2c(n1)cccc2)C(=O)N[C@@H]1COC(=O)C(N(C(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@@H](COC(=O)[C@@H](N(C(=O)C(N(C(=O)[C@@H](NC1=O)C)C)C(SC2)SC)C)C(C)C)NC(=O)c1cnc2c(n1)cccc2)C)C)C)C(C)C Canonical SMILES: CSC1SC[C@@H]2N(C)C(=O)[C@H](C)NC(=O)[C@@H](COC(=O)[C@@H](N(C(=O)C1N(C)C(=O)[C@H](C)NC(=O)[C@@H](COC(=O)C(N(C2=O)C)C(C)C)NC(=O)c1cnc2c(n1)cccc2)C)C(C)C)NC(=O)c1cnc2c(n1)cccc2 InChI: InChI=1S/C51H64N12O12S2/c1-25(2)38-49(72)74-22-36(59-42(65)34-21-53-30-17-13-15-19-32(30)57-34)44(67)55-28(6)46(69)63(10)40-48(71)62(9)39(26(3)4)50(73)75-23-35(58-41(64)33-20-52-29-16-12-14-18-31(29)56-33)43(66)54-27(5)45(68)60(7)37(47(70)61(38)8)24-77-51(40)76-11/h12-21,25-28,35-40,51H,22-24H2,1-11H3,(H,54,66)(H,55,67)(H,58,64)(H,59,65)/t27-,28-,35+,36+,37-,38?,39-,40?,51?/m0/s1 InChIKey: AUJXLBOHYWTPFV-MTLXMOHPSA-N
CBID:312839 http://www.chembase.cn/molecule-312839.html