Chemical Compound

J2.945.757C

J2.945.757C chemical structure
Primary Record

J2.945.757C

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101792698
SMILES
CCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1C[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2C1)CC4=CC=CC=C4)CC(C)C)CCCN)C(C)C)CC5=CC=CC=C5)CC(C)C)CCCN)C(C)C
Canonical SMILES
CCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1C[C@H]2C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](Cc3ccccc3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](Cc3ccccc3)C(=O)N2C1

Names & Synonyms

  • J2.945.757C
  • Cyclo[L-Val-L-Orn-L-Leu-D-Phe-4alpha-[(Nalpha-octanoyl-Lys-Lys-)amino]-L-Pro-L-Val-L-Orn-L-Leu-D-Phe-L-Pro-]
  • N-[(1S)-5-amino-1-{[(1S)-5-amino-1-{[(3R,6S,9S,12S,15S,17S,21R,24S,27S,30S,33S)-9,27-bis(3-aminopropyl)-3,21-dibenzyl-6,24-bis(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-12,30-bis(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.015,19]hexatriacontan-17-yl]carbamoyl}pentyl]carbamoyl}pentyl]octanamide