(3S,6S,9R,14R,17S,20S,23S,32S,35S,38S,41S,44S,49aS)-14-amino-17,20,32,35-tetrabenzyl-3,23-bis(3-carbamimidamidopropyl)-38,44-bis(carbamoylmethyl)-6-[(4-hydroxyphenyl)methyl]-41-[(1H-imidazol-4-yl)methyl]-1,4,7,15,18,21,24,27,30,33,36,39,42,45-tetradecaoxo-hexatetracontahydro-1H-pyrrolo[2,1-m]1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44-tetradecaazacycloheptatetracontane-9-carboxylic acid

化合物标识与属性

PubChem CID

177447747

SMILES

C1C[C@H]2C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N2C1)CC(=O)N)CC3=CNC=N3)CC(=O)N)CC4=CC=CC=C4)CC5=CC=CC=C5)CCCNC(=N)N)CC6=CC=CC=C6)CC7=CC=CC=C7)N)C(=O)O)CC8=CC=C(C=C8)O)CCCNC(=N)N

Canonical SMILES

N=C(N)NCCCC1NC(=O)C(Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)O)NC(=O)C(Cc2ccc(O)cc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(N)=O)NC(=O)C(Cc2c[nH]cn2)NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC1=O