Val-Asp-Arg

Properties Image MNX_ID MNXM1128075 reference chebi:166114 formula C15H28N6O6 global charge 0 mol weight 388.425 InChIKey XQVRMLRMTAGSFJ-QXEWZRGKSA-N InChI InChI=1S/C15H28N6O6/c1-7(2)11(16)13(25)21-9(6-10(22)23)12(24)20-8(14(26)27)4-3-5-19-15(17)18/h7-9,11H,3-6,16H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)(H,26,27)(H4,17,18,19)/t8-,9-,11-/m0/s1 SMILES CC(C)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O MNX internals InChI (mnx) InChI=1/C15H28N6O6/c1-7(2)11(16)13(25)21-9(6-10(22)23)12(24)20-8(14(26)27)4-3-5-19-15(17)18/h7-9,11H,3-6,16H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)(H,26,27)(H4,17,18,19)/t8-,9-,11-/m0/s1 SMILES (mnx) [CH3:1][CH:7]([CH3:2])[C@@H:11]([C:13](=[N:21][C@@H:9]([CH2:6][C:10](=[O:22])[OH:23])[C:12](=[N:20][C@@H:8]([CH2:4][CH2:3][CH2:5][NH:19][C:15](=[NH:17])[NH2:18])[C:14](=[O:26])[OH:27])[OH:24])[OH:25])[NH2:16]

Parent-child relations graph

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