Chemical Compound

J1.445.801H

J1.445.801H chemical structure
Primary Record

J1.445.801H

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177465714
SMILES
C[C@H]([C@@H](C(=O)N)NC(=O)C1CSSC[C@@H](C(=O)NC(C(=O)N[C@@H](C(=O)N[C@H](C(=O)NC(C(=O)N1)C(C)(C)O)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)[C@@H](CC5=CC=CC=C5)N)O
Canonical SMILES
C[C@@H](O)[C@H](NC(=O)C1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)NC(Cc2ccccc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)NC(C(C)(C)O)C(=O)N1)C(N)=O

Names & Synonyms

  • J1.445.801H
  • J1.445.811E
  • D-Phe-L-Cys(1)-L-Phe-D-Trp-L-Lys-3-Hydroxy-D-Val-L-Cys(1)-L-Thr-NH2
  • D-Phe-L-Cys(1)-L-Phe-D-Trp-L-Lys-3-Hydroxy-L-Val-L-Cys(1)-L-Thr-NH2
  • (2S,3R)-2-{[(4R,7R,10S,13R,16S,19R)-19-[(2R)-2-amino-3-phenylpropanamido]-10-(4-aminobutyl)-16-benzyl-7-(2-hydroxypropan-2-yl)-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-3-hydroxybutanamide
  • (2S,3R)-2-{[(4R,7S,10S,13R,16S,19R)-19-[(2R)-2-amino-3-phenylpropanamido]-10-(4-aminobutyl)-16-benzyl-7-(2-hydroxypropan-2-yl)-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-3-hydroxybutanamide