Valyl-Arginyl-Glycine

Properties Image MNX_ID MNXM744973 reference biggM:valarggly formula C13H27N6O4 global charge 1 mol weight 331.397 InChIKey COYSIHFOCOMGCF-WCBMZHEXSA-O InChI InChI=1S/C13H26N6O4/c1-7(2)10(14)12(23)19-8(4-3-5-17-13(15)16)11(22)18-6-9(20)21/h7-8,10H,3-6,14H2,1-2H3,(H,18,22)(H,19,23)(H,20,21)(H4,15,16,17)/p+1/t8-,10+/m0/s1 SMILES CC(C)[C@@H](N)C(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)NCC(=O)O MNX internals InChI (mnx) InChI=1/C13H26N6O4/c1-7(2)10(14)12(23)19-8(4-3-5-17-13(15)16)11(22)18-6-9(20)21/h7-8,10H,3-6,14H2,1-2H3,(H,18,22)(H,19,23)(H,20,21)(H4,15,16,17)/t8-,10+/m0/s1 SMILES (mnx) [CH3:1][CH:7]([CH3:2])[C@H:10]([C:12](=[N:19][C@@H:8]([CH2:4][CH2:3][CH2:5][NH:17][C:13](=[NH:15])[NH2:16])[C:11](=[N:18][CH2:6][C:9](=[O:20])[OH:21])[OH:22])[OH:23])[NH2:14]

Parent-child relations graph

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