Thr-Asp-Asp

Properties Image MNX_ID MNXM1126321 reference chebi:163735 formula C12H19N3O9 global charge 0 mol weight 349.296 InChIKey YOSLMIPKOUAHKI-OLHMAJIHSA-N InChI InChI=1S/C12H19N3O9/c1-4(16)9(13)11(22)14-5(2-7(17)18)10(21)15-6(12(23)24)3-8(19)20/h4-6,9,16H,2-3,13H2,1H3,(H,14,22)(H,15,21)(H,17,18)(H,19,20)(H,23,24)/t4-,5+,6+,9+/m1/s1 SMILES C[C@@H](O)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C12H19N3O9/c1-4(16)9(13)11(22)14-5(2-7(17)18)10(21)15-6(12(23)24)3-8(19)20/h4-6,9,16H,2-3,13H2,1H3,(H,14,22)(H,15,21)(H,17,18)(H,19,20)(H,23,24)/t4-,5+,6+,9+/m1/s1 SMILES (mnx) [CH3:1][C@H:4]([C@@H:9]([C:11](=[N:14][C@@H:5]([CH2:2][C:7](=[O:17])[OH:18])[C:10](=[N:15][C@@H:6]([CH2:3][C:8](=[O:19])[OH:20])[C:12](=[O:23])[OH:24])[OH:21])[OH:22])[NH2:13])[OH:16]

Parent-child relations graph

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