Chemical Compound

J1.778.052B

J1.778.052B chemical structure
Primary Record

J1.778.052B

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
13961562
SMILES
C[C@H]([C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2CCC[C@@H]2C(=O)N[C@H](C(=O)N1)CC3=CC=CC=C3)CC4=CC=CC=C4)CC5=CNC6=CC=CC=C65)CCCCNC(=O)OCC7=CC=CC=C7)O
Canonical SMILES
C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCCNC(=O)OCc2ccccc2)NC1=O

Names & Synonyms

  • J1.778.052B
  • cyclo(-D-Pro1-Phe2-Thr3-Lys(Z)4-Trp5-Phe6-)
  • Cyclo(D-Pro-L-Phe-L-Thr-N6-Z-L-Lys-L-Trp-L-Phe-)
  • benzyl N-{4-[(3S,6S,9S,12S,15S,20aR)-3,15-dibenzyl-6-[(1R)-1-hydroxyethyl]-12-[(1H-indol-3-yl)methyl]-1,4,7,10,13,16-hexaoxo-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecan-9-yl]butyl}carbamate