Chemical Compound

J1.006.961K

J1.006.961K chemical structure
Primary Record

J1.006.961K

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177636297
SMILES
CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@H]2CCCCNC(=O)C(NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H]3CCCN3C2=O)CC4CCCCC4)CC5=CNC6=CC=CC=C65)CCCN=C(N)N
Canonical SMILES
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)C(CCCN=C(N)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C1=O

Names & Synonyms

  • J1.006.961K
  • N2-(Ac-L-Phe-)Cyclo(L-Lys*-L-Pro-3-cyclohexyl-D-Ala-L-Trp-D-Arg-)
  • (2S)-N-[(3R,6S,9R,16S,21aS)-9-(3-carbamimidamidopropyl)-3-(cyclohexylmethyl)-6-[(1H-indol-3-yl)methyl]-1,4,7,10,17-pentaoxo-icosahydro-1H-pyrrolo[1,2-a]1,4,7,10,13-pentaazacyclononadecan-16-yl]-2-acetamido-3-phenylpropanamide
  • (3S,10R,13S,16R,19S)-3-[(N-Acetyl-L-phenylalanyl)amino]-10-(3-guanidinopropyl)-13-(1H-indole-3-ylmethyl)-16-(cyclohexylmethyl)-1,8,11,14,17-pentaazabicyclo[17.3.0]docosane-2,9,12,15,18-pentone