Chemical Compound

CHEMBL5909134

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CHEMBL5909134 chemical structure
Primary Record

CHEMBL5909134

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
121428739
SMILES
CC(C)(C)[C@H](C1=CC(=CN1CC2=CC=CC=C2)C3=C(C=CC(=C3)F)F)N(CC[C@@H](C(=O)NCCNC(=O)CNC(=O)C(CC(=O)O)SC[C@@H](C(=O)O)N)N)C(=O)CO
Canonical SMILES
CC(C)(C)[C@H](c1cc(-c2cc(F)ccc2F)cn1Cc1ccccc1)N(CC[C@H](N)C(=O)NCCNC(=O)CNC(=O)C(CC(=O)O)SC[C@H](N)C(=O)O)C(=O)CO

Names & Synonyms

  • CHEMBL5909134
  • SCHEMBL17860167
  • SCHEMBL29396337
  • BDBM509102
  • US11071788, Example M15
  • US11071788, Example M16
  • US11071788, Example M27
  • 4-[(2-{[2-({(2S)-2-Amino-4-[{(1R)-1-[1-benzyl-4-(2,5-difluorophenyl)-1H-pyrrol-2-yl]-2,2-dimethylpropyl}(glycoloyl)amino]butanoyl}amino)ethyl]amino}-2-oxoethyl)amino]-3-{[(2R)-2-amino-2-carboxyethyl]sulphanyl}-4-oxobutanoic acid/trifluoroacetic acid (1.1) Regioisomer 2, Epimer 1 (3R or 3S)