(2S)-6-amino-2-{[(2R)-1-[(4S,7R,10R,13R,16R,19S)-19-amino-13-benzyl-10-(2-carbamoylethyl)-7-(carbamoylmethyl)-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl]pyrrolidin-2-yl]formamido}-N-(carbamoylmethyl)hexanamide; acetic acid

化合物标识与属性

CAS

83968-49-4

PubChem CID

175688014

SMILES

CC(=O)O.C1C[C@@H](N(C1)C(=O)C2CSSC[C@H](C(=O)NC(C(=O)N[C@@H](C(=O)N[C@@H](C(=O)NC(C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N

Canonical SMILES

CC(=O)O.NCCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)C1CSSC[C@@H](N)C(=O)NC(Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)NC(CC(N)=O)C(=O)N1)C(=O)NCC(N)=O