Met-Trp-Gly

Properties Image MNX_ID MNXM1123735 reference chebi:161137 formula C18H24N4O4S global charge 0 mol weight 392.481 InChIKey KLGIQJRMFHIGCQ-ZFWWWQNUSA-N InChI InChI=1S/C18H24N4O4S/c1-27-7-6-13(19)17(25)22-15(18(26)21-10-16(23)24)8-11-9-20-14-5-3-2-4-12(11)14/h2-5,9,13,15,20H,6-8,10,19H2,1H3,(H,21,26)(H,22,25)(H,23,24)/t13-,15-/m0/s1 SMILES CSCC[C@H](N)C(=O)N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)NCC(=O)O MNX internals InChI (mnx) InChI=1/C18H24N4O4S/c1-27-7-6-13(19)17(25)22-15(18(26)21-10-16(23)24)8-11-9-20-14-5-3-2-4-12(11)14/h2-5,9,13,15,20H,6-8,10,19H2,1H3,(H,21,26)(H,22,25)(H,23,24)/t13-,15-/m0/s1 SMILES (mnx) [CH3:1][S:27][CH2:7][CH2:6][C@@H:13]([C:17](=[N:22][C@@H:15]([CH2:8][C:11]1=[CH:9][NH:20][C:14]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:12]12)[C:18](=[N:21][CH2:10][C:16](=[O:23])[OH:24])[OH:26])[OH:25])[NH2:19]

Parent-child relations graph

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