Product Name
Octreotide trifluoroacetate salt (Dimer, Antiparallel)
Product Number
CPTD787910
Certificate of Analysis (COA)
IUPAC Name
(4R,7S,10S,13R,16S,19R,24R,27S,30S,33R,36S,39S)-10,30-bis(4-aminobutyl)-19,39-bis(2R)-2-amino-3-phenylpropanoylamino-16,36-dibenzyl-4-N,24-N-bis(2R,3R)-1,3-dihydroxybutan-2-yl-7,27-bis(1R)-1-hydroxyethyl-13,33-bis(1H-indol-3-ylmethyl)-6,9,12,15,18,26,29,32,35,38-decaoxo-1,2,21,22-tetrathia-5,8,11,14,17,25,28,31,34,37-decazacyclotetracontane-4,24-dicarboxamide;2,2,2-trifluoroacetic acid
InChI Key
KMCKZYFPLRFRPK-WGTYXJJASA-N
SMILES
CC@H(C@H1C(=O)NC@@H(CSSCC@H(C(=O)NC@H(C(=O)NC@@H(C(=O)NC@H(C(=O)NC@H(C(=O)NC@@H(CSSCC@@H(C(=O)NC@H(C(=O)NC@@H(C(=O)NC@H(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)C@@H(CC5=CC=CC=C5)N)C(=O)NC@H(CO)C@@H(C)O)C@@H(C)O)CCCCN)CC6=CNC7=CC=CC=C76)CC8=CC=CC=C8)NC(=O)C@@H(CC9=CC=CC=C9)N)C(=O)NC@H(CO)C@@H(C)O)O.C(=O)(C(F)(F)F)O