Lys-His-Met

Properties Image MNX_ID MNXM1122610 reference chebi:160004 formula C17H30N6O4S global charge 0 mol weight 414.532 InChIKey YXTKSLRSRXKXNV-IHRRRGAJSA-N InChI InChI=1S/C17H30N6O4S/c1-28-7-5-13(17(26)27)22-16(25)14(8-11-9-20-10-21-11)23-15(24)12(19)4-2-3-6-18/h9-10,12-14H,2-8,18-19H2,1H3,(H,20,21)(H,22,25)(H,23,24)(H,26,27)/t12-,13-,14-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H](N)CCCCN)C(=O)O MNX internals InChI (mnx) InChI=1/C17H30N6O4S/c1-28-7-5-13(17(26)27)22-16(25)14(8-11-9-20-10-21-11)23-15(24)12(19)4-2-3-6-18/h9-10,12-14H,2-8,18-19H2,1H3,(H,20,21)(H,22,25)(H,23,24)(H,26,27)/t12-,13-,14-/m0/s1 SMILES (mnx) [CH3:1][S:28][CH2:7][CH2:5][C@@H:13]([C:17](=[O:26])[OH:27])[N:22]=[C:16]([C@H:14]([CH2:8][C:11]1=[CH:9][N:20]=[CH:10][NH:21]1)[N:23]=[C:15]([C@H:12]([CH2:4][CH2:2][CH2:3][CH2:6][NH2:18])[NH2:19])[OH:24])[OH:25]

Parent-child relations graph

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