2-[(2S)-2-[2-(2-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanamido]-3-(1H-indol-3-yl)propanamido]-4-(methylsulfanyl)butanamido]-4-carbamoylbutanamido]propanoyl]pyrrolidin-2-yl]formamido}acetamido)acetamido]-6-{[(6-{[(6-methyl-4-oxo-1,4-dihydropyrimidin-2-yl)carbamoyl]amino}hexyl)carbamoyl]amino}hexanamido]acetic acid

化合物标识与属性

PubChem CID

135627700

SMILES

CC1=CC(=O)NC(=N1)NC(=O)NCCCCCCNC(=O)NCCCC[C@@H](C(=O)NCC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC5=CN=CN5)N

Canonical SMILES

CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1cnc[nH]1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)NCCCCCCNC(=O)Nc1nc(C)cc(=O)[nH]1)C(=O)NCC(=O)O