Chemical Compound

CHEMBL96119

CHEMBL96119 chemical structure
Primary Record

CHEMBL96119

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
10795810
SMILES
C1CCCC(CCC1)(C(=O)NCC(=O)N[C@@H](CO)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)N
Canonical SMILES
NCCCC[C@H](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)NC1(C(=O)NCC(=O)N[C@@H](CO)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)O)CCCCCCC1

Names & Synonyms

  • CHEMBL96119
  • CID10795810
  • CID 10795810
  • J1.489.742I
  • [1-(Lys-Arg-Gly-Amino-)cyclooctylcarbonyl]-Gly-Ser-Pro-Phe-OH
  • (2S)-2-{[(2S)-1-[(2S)-2-{2-[(1-{2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]acetamido}cyclooctyl)formamido]acetamido}-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanoic acid