(2S)-N-[2-({[(2-{[(1S)-1-{[(1R)-1-{[(1S)-4-carbamimidamido-1-{[(1S)-1-carbamoyl-2-(1H-indol-3-yl)ethyl]carbamoyl}butyl]carbamoyl}-2-phenylethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl)carbamoyl]methyl}carbamoyl)ethyl]-6-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2R)-2-[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]pentanamido]-3-(1H-indol-3-yl)propanamido]-2-[3-(2-{3-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2R)-2-[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]pentanamido]-3-(1H-indol-3-yl)propanamido]propanamido}acetamido)propanamido]hexanamide

化合物标识与属性

PubChem CID

177596027

SMILES

CC(=O)N[C@@H](CC1=CNC=N1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)NCCCC[C@@H](C(=O)NCCC(=O)NCC(=O)NCCC(=O)N[C@@H](CC5=CNC=N5)C(=O)N[C@H](CC6=CC=CC=C6)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC7=CNC8=CC=CC=C87)C(=O)N)NC(=O)CCNC(=O)CNC(=O)CCNC(=O)[C@H](CC9=CNC1=CC=CC=C19)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CC1=CNC=N1)NC(=O)C

Canonical SMILES

CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCC[C@H](NC(=O)CCNC(=O)CNC(=O)CCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(C)=O)C(=O)NCCC(=O)NCC(=O)NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O