59004-96-5

α-Endorphin (human, mouse, rat, porcine, bovine, ovine)

IUPAC Name: (2S,11S,14S,17S,20S,23S)-2-amino-23-(((S)-6-amino-1-(((S)-1-(((S)-5-amino-1-(((2S,3R)-1-((S)-2-(((S)-1-(((S)-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-3-hydroxy-1-oxobutan-2-yl)amino)-1,5-dioxopentan-2-yl)amino)-3-hydroxy-1-oxopropan-2-yl)amino)-1-oxohexan-2-yl)carbamoyl)-11-benzyl-17-((R)-1-hydroxyethyl)-20-(hydroxymethyl)-1-(4-hydroxyphenyl)-14-(2-(methylthio)ethyl)-3,6,9,12,15,18,21-heptaoxo-4,7,10,13,16,19,22-heptaazahexacosan-26-oic acid

InChIKey: NXSIJWJXMWBCBX-NWKQFZAZSA-N

SMILES: OC(C=C1)=CC=C1C[C@H](N)C(NCC(NCC(N[C@@H](CC2=CC=CC=C2)C(N[C@@H](CCSC)C(N[C@@H]([C@H](O)C)C(N[C@@H](CO)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCCN)C(N[C@@H](CO)C(N[C@@H](CCC(N)=O)C(N[C@@H]([C@H](O)C)C(N3[C@@H](CCC3)C(N[C@@H](CC(C)C)C(N[C@@H](C(C)C)C(N[C@H](C(O)=O)[C@H](O)C)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O