Chemical Compound

Somatuline

Somatuline chemical structure
Primary Record

Somatuline

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177542170
SMILES
C[C@H]([C@@H](C(=O)N)NC(=O)C1CSSCC(C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)N1)C(C)C)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)NC(=O)[C@@H](CC5=CC6=CC=CC=C6C=C5)N)OC(=O)C
Canonical SMILES
CC(=O)O[C@H](C)[C@H](NC(=O)C1CSSCC(NC(=O)[C@H](N)Cc2ccc3ccccc3c2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)NC(C(C)C)C(=O)N1)C(N)=O

Names & Synonyms

  • Somatuline
  • Lanreotide acetate
  • J3.125.691G
  • 3-(2-Naphthyl)-D-Ala-L-Cys(1)-L-Tyr-D-Trp-L-Lys-L-Val-L-Cys(1)-O-acetyl-L-Thr-NH2
  • (1S,2R)-1-{[(4R,7S,10S,13R,16S,19R)-19-[(2R)-2-amino-3-(naphthalen-2-yl)propanamido]-10-(4-aminobutyl)-16-[(4-hydroxyphenyl)methyl]-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-7-(propan-2-yl)-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-1-carbamoylpropan-2-yl acetate