Trp-Met-Arg

Properties Image MNX_ID MNXM744942 reference chebi:164773 formula C22H33N7O4S global charge 0 mol weight 491.618 InChIKey SNWIAPVRCNYFNI-SZMVWBNQSA-N InChI InChI=1S/C22H33N7O4S/c1-34-10-8-17(20(31)29-18(21(32)33)7-4-9-26-22(24)25)28-19(30)15(23)11-13-12-27-16-6-3-2-5-14(13)16/h2-3,5-6,12,15,17-18,27H,4,7-11,23H2,1H3,(H,28,30)(H,29,31)(H,32,33)(H4,24,25,26)/t15-,17-,18-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O MNX internals InChI (mnx) InChI=1/C22H33N7O4S/c1-34-10-8-17(20(31)29-18(21(32)33)7-4-9-26-22(24)25)28-19(30)15(23)11-13-12-27-16-6-3-2-5-14(13)16/h2-3,5-6,12,15,17-18,27H,4,7-11,23H2,1H3,(H,28,30)(H,29,31)(H,32,33)(H4,24,25,26)/t15-,17-,18-/m0/s1 SMILES (mnx) [CH3:1][S:34][CH2:10][CH2:8][C@@H:17]([C:20](=[N:29][C@@H:18]([CH2:7][CH2:4][CH2:9][NH:26][C:22](=[NH:24])[NH2:25])[C:21](=[O:32])[OH:33])[OH:31])[N:28]=[C:19]([C@H:15]([CH2:11][C:13]1=[CH:12][NH:27][C:16]2=[CH:6][CH:3]=[CH:2][CH:5]=[C:14]12)[NH2:23])[OH:30]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 3