Asp-Thr-Glu

Properties Image MNX_ID MNXM1123518 reference chebi:160919 formula C13H21N3O9 global charge 0 mol weight 363.323 InChIKey GWWSUMLEWKQHLR-NUMRIWBASA-N InChI InChI=1S/C13H21N3O9/c1-5(17)10(16-11(22)6(14)4-9(20)21)12(23)15-7(13(24)25)2-3-8(18)19/h5-7,10,17H,2-4,14H2,1H3,(H,15,23)(H,16,22)(H,18,19)(H,20,21)(H,24,25)/t5-,6+,7+,10+/m1/s1 SMILES C[C@@H](O)[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/C13H21N3O9/c1-5(17)10(16-11(22)6(14)4-9(20)21)12(23)15-7(13(24)25)2-3-8(18)19/h5-7,10,17H,2-4,14H2,1H3,(H,15,23)(H,16,22)(H,18,19)(H,20,21)(H,24,25)/t5-,6+,7+,10+/m1/s1 SMILES (mnx) [CH3:1][C@H:5]([C@@H:10]([C:12](=[N:15][C@@H:7]([CH2:2][CH2:3][C:8](=[O:18])[OH:19])[C:13](=[O:24])[OH:25])[OH:23])[N:16]=[C:11]([C@H:6]([CH2:4][C:9](=[O:20])[OH:21])[NH2:14])[OH:22])[OH:17]

Parent-child relations graph

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