Val-Asp-Phe

Properties Image MNX_ID MNXM1128087 reference chebi:166126 formula C18H25N3O6 global charge 0 mol weight 379.413 InChIKey HHSILIQTHXABKM-YDHLFZDLSA-N InChI InChI=1S/C18H25N3O6/c1-10(2)15(19)17(25)20-12(9-14(22)23)16(24)21-13(18(26)27)8-11-6-4-3-5-7-11/h3-7,10,12-13,15H,8-9,19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t12-,13-,15-/m0/s1 SMILES CC(C)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C18H25N3O6/c1-10(2)15(19)17(25)20-12(9-14(22)23)16(24)21-13(18(26)27)8-11-6-4-3-5-7-11/h3-7,10,12-13,15H,8-9,19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t12-,13-,15-/m0/s1 SMILES (mnx) [CH3:1][CH:10]([CH3:2])[C@@H:15]([C:17](=[N:20][C@@H:12]([CH2:9][C:14](=[O:22])[OH:23])[C:16](=[N:21][C@@H:13]([CH2:8][C:11]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1)[C:18](=[O:26])[OH:27])[OH:24])[OH:25])[NH2:19]

Parent-child relations graph

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