Asp-Ala-Glu

Properties Image MNX_ID MNXM1122892 reference chebi:160289 formula C12H19N3O8 global charge 0 mol weight 333.297 InChIKey XEDQMTWEYFBOIK-ACZMJKKPSA-N InChI InChI=1S/C12H19N3O8/c1-5(14-11(21)6(13)4-9(18)19)10(20)15-7(12(22)23)2-3-8(16)17/h5-7H,2-4,13H2,1H3,(H,14,21)(H,15,20)(H,16,17)(H,18,19)(H,22,23)/t5-,6-,7-/m0/s1 SMILES C[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C12H19N3O8/c1-5(14-11(21)6(13)4-9(18)19)10(20)15-7(12(22)23)2-3-8(16)17/h5-7H,2-4,13H2,1H3,(H,14,21)(H,15,20)(H,16,17)(H,18,19)(H,22,23)/t5-,6-,7-/m0/s1 SMILES (mnx) [CH3:1][C@@H:5]([C:10](=[N:15][C@@H:7]([CH2:2][CH2:3][C:8](=[O:16])[OH:17])[C:12](=[O:22])[OH:23])[OH:20])[N:14]=[C:11]([C@H:6]([CH2:4][C:9](=[O:18])[OH:19])[NH2:13])[OH:21]

Parent-child relations graph

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