Asp-Cys-Arg

Properties Image MNX_ID MNXM1123040 reference chebi:160439 formula C13H24N6O6S global charge 0 mol weight 392.438 InChIKey FMWHSNJMHUNLAG-FXQIFTODSA-N InChI InChI=1S/C13H24N6O6S/c14-6(4-9(20)21)10(22)19-8(5-26)11(23)18-7(12(24)25)2-1-3-17-13(15)16/h6-8,26H,1-5,14H2,(H,18,23)(H,19,22)(H,20,21)(H,24,25)(H4,15,16,17)/t6-,7-,8-/m0/s1 SMILES NC(N)=NCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C13H24N6O6S/c14-6(4-9(20)21)10(22)19-8(5-26)11(23)18-7(12(24)25)2-1-3-17-13(15)16/h6-8,26H,1-5,14H2,(H,18,23)(H,19,22)(H,20,21)(H,24,25)(H4,15,16,17)/t6-,7-,8-/m0/s1 SMILES (mnx) [CH2:1]([CH2:2][C@@H:7]([C:12](=[O:24])[OH:25])[N:18]=[C:11]([C@H:8]([CH2:5][SH:26])[N:19]=[C:10]([C@H:6]([CH2:4][C:9](=[O:20])[OH:21])[NH2:14])[OH:22])[OH:23])[CH2:3][NH:17][C:13](=[NH:15])[NH2:16]

Parent-child relations graph

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