Leu-Met-Arg

Properties Image MNX_ID MNXM1121980 reference chebi:159369 formula C17H34N6O4S global charge 0 mol weight 418.564 InChIKey PKKMDPNFGULLNQ-AVGNSLFASA-N InChI InChI=1S/C17H34N6O4S/c1-10(2)9-11(18)14(24)22-12(6-8-28-3)15(25)23-13(16(26)27)5-4-7-21-17(19)20/h10-13H,4-9,18H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)(H4,19,20,21)/t11-,12-,13-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O MNX internals InChI (mnx) InChI=1/C17H34N6O4S/c1-10(2)9-11(18)14(24)22-12(6-8-28-3)15(25)23-13(16(26)27)5-4-7-21-17(19)20/h10-13H,4-9,18H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)(H4,19,20,21)/t11-,12-,13-/m0/s1 SMILES (mnx) [CH3:1][CH:10]([CH3:2])[CH2:9][C@@H:11]([C:14](=[N:22][C@@H:12]([CH2:6][CH2:8][S:28][CH3:3])[C:15](=[N:23][C@@H:13]([CH2:5][CH2:4][CH2:7][NH:21][C:17](=[NH:19])[NH2:20])[C:16](=[O:26])[OH:27])[OH:25])[OH:24])[NH2:18]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0