Cys-Gly-Trp

Properties Image MNX_ID MNXM1123973 reference chebi:161375 formula C16H20N4O4S global charge 0 mol weight 364.427 InChIKey JDHMXPSXWMPYQZ-AAEUAGOBSA-N InChI InChI=1S/C16H20N4O4S/c17-11(8-25)15(22)19-7-14(21)20-13(16(23)24)5-9-6-18-12-4-2-1-3-10(9)12/h1-4,6,11,13,18,25H,5,7-8,17H2,(H,19,22)(H,20,21)(H,23,24)/t11-,13-/m0/s1 SMILES N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O MNX internals InChI (mnx) InChI=1/C16H20N4O4S/c17-11(8-25)15(22)19-7-14(21)20-13(16(23)24)5-9-6-18-12-4-2-1-3-10(9)12/h1-4,6,11,13,18,25H,5,7-8,17H2,(H,19,22)(H,20,21)(H,23,24)/t11-,13-/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:12]2[C:10](=[CH:3]1)[C:9]([CH2:5][C@@H:13]([C:16](=[O:23])[OH:24])[N:20]=[C:14]([CH2:7][N:19]=[C:15]([C@H:11]([CH2:8][SH:25])[NH2:17])[OH:22])[OH:21])=[CH:6][NH:18]2

Parent-child relations graph

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