2-[(7S,10S,13S,16S,19S,22S,25S,28S,31S)-28-(4-aminobutyl)-10,19-dibenzyl-22-[(2S)-butan-2-yl]-25-(3-carbamimidamidopropyl)-31-(hydroxymethyl)-16-(2-methylpropyl)-2,8,11,14,17,20,23,26,29,32-decaoxo-3,9,12,15,18,21,24,27,30,33-decaazatetracyclo[40.4.0.03,7.034,39]hexatetraconta-1(46),34,36,38,42,44-hexaen-40-yn-13-yl]acetic acid

化合物标识与属性

PubChem CID

57381144

SMILES

CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NC2=CC=CC=C2C#CC3=CC=CC=C3C(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC5=CC=CC=C5)CC(C)C)CC(=O)O)CC6=CC=CC=C6)CO)CCCCN)CCCN=C(N)N

Canonical SMILES

CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2C#Cc2ccccc2NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O