(2S)-2,6-diamino-N-[(1S,2R)-1-{[(2S)-4-amino-1-oxo-1-[(2S,5S,8R,11S,14S,17S,20S)-2,5,14,17-tetrakis(2-aminoethyl)-8-benzyl-20-[(1R)-1-hydroxyethyl]-11-(2-methylpropyl)-3,6,9,12,15,18,21-heptaoxo-1,4,7,10,13,16,19-heptaazacyclohenicosan-1-yl]butan-2-yl]carbamoyl}-2-hydroxypropyl]hexanamide

化合物标识与属性

PubChem CID

102284326

SMILES

C[C@H]([C@H]1C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCN)CCN)CC(C)C)CC2=CC=CC=C2)CCN)CCN)C(=O)[C@H](CCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)N)O

Canonical SMILES

CC(C)C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)N(C(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC1=O