Chemical Compound

CHEMBL268094

CHEMBL268094 chemical structure
Primary Record

CHEMBL268094

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
44348183
SMILES
CC(=O)[C@@H]1CSSC[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](NC1=O)CCC(=O)O)CC3=CC4=CC=CC=C4C=C3)CCCN=C(N)N)CC5=CNC6=CC=CC=C65)C(=O)N7CCC[C@H]7C(=O)CN8CCC[C@H]8C(=O)CN[C@@H](CCCCN)C(=O)CN[C@@H](CC(=O)O)C(=O)N
Canonical SMILES
CC(=O)[C@@H]1CSSC[C@H](C(=O)N2CCC[C@H]2C(=O)CN2CCC[C@H]2C(=O)CN[C@@H](CCCCN)C(=O)CN[C@@H](CC(=O)O)C(N)=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCC(=O)O)NC1=O

Names & Synonyms

  • CHEMBL268094
  • BDBM50131877
  • Ac-c[Cys-Glu-Pro-D-Nal(2'')-Arg-Trp-Cys]-Pro-Pro-Lys-Asp-NH2