Met-Gly-Glu

Properties Image MNX_ID MNXM1123336 reference chebi:160737 formula C12H21N3O6S global charge 0 mol weight 335.382 InChIKey YCUSPBPZVJDMII-YUMQZZPRSA-N InChI InChI=1S/C12H21N3O6S/c1-22-5-4-7(13)11(19)14-6-9(16)15-8(12(20)21)2-3-10(17)18/h7-8H,2-6,13H2,1H3,(H,14,19)(H,15,16)(H,17,18)(H,20,21)/t7-,8-/m0/s1 SMILES CSCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C12H21N3O6S/c1-22-5-4-7(13)11(19)14-6-9(16)15-8(12(20)21)2-3-10(17)18/h7-8H,2-6,13H2,1H3,(H,14,19)(H,15,16)(H,17,18)(H,20,21)/t7-,8-/m0/s1 SMILES (mnx) [CH3:1][S:22][CH2:5][CH2:4][C@@H:7]([C:11](=[N:14][CH2:6][C:9](=[N:15][C@@H:8]([CH2:2][CH2:3][C:10](=[O:17])[OH:18])[C:12](=[O:20])[OH:21])[OH:16])[OH:19])[NH2:13]

Parent-child relations graph

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