2-({[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}imino)-N-{4-[(3S,6S,9S,15S,21S,24S,27S,33S)-3,21,27-tris({4-[2-({[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}imino)acetamido]butyl})-6,24-dimethyl-2,5,8,11,14,20,23,26,29,32-decaoxo-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.015,19]hexatriacontan-9-yl]butyl}acetamide

化合物标识与属性

PubChem CID

177522563

SMILES

C[C@@H]1NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]3N(C(=O)[C@@H](NC1=O)CCCCNC(=O)/C=N/O[C@@H]4O[C@@H]([C@@H]([C@@H]([C@H]4NC(=O)C)O)O)CO)CCC3)CCCCNC(=O)/C=N/O[C@@H]5O[C@@H]([C@@H]([C@@H]([C@H]5NC(=O)C)O)O)CO)C)CCCCNC(=O)/C=N/O[C@@H]6O[C@@H]([C@@H]([C@@H]([C@H]6NC(=O)C)O)O)CO)CCC2)CCCCNC(=O)/C=N/O[C@@H]7O[C@@H]([C@@H]([C@@H]([C@H]7NC(=O)C)O)O)CO

Canonical SMILES

CC(=O)N[C@H]1[C@H](O/N=C/C(=O)NCCCC[C@@H]2NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(=O)/C=N/O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3NC(C)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCNC(=O)/C=N/O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3NC(C)=O)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(=O)/C=N/O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3NC(C)=O)NC(=O)[C@H](C)NC2=O)O[C@H](CO)[C@H](O)[C@@H]1O