Ala-Asp-Asp

Properties Image MNX_ID MNXM1120645 reference chebi:158026 formula C11H17N3O8 global charge 0 mol weight 319.27 InChIKey WXERCAHAIKMTKX-ZLUOBGJFSA-N InChI InChI=1S/C11H17N3O8/c1-4(12)9(19)13-5(2-7(15)16)10(20)14-6(11(21)22)3-8(17)18/h4-6H,2-3,12H2,1H3,(H,13,19)(H,14,20)(H,15,16)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1 SMILES C[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/C11H17N3O8/c1-4(12)9(19)13-5(2-7(15)16)10(20)14-6(11(21)22)3-8(17)18/h4-6H,2-3,12H2,1H3,(H,13,19)(H,14,20)(H,15,16)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1 SMILES (mnx) [CH3:1][C@@H:4]([C:9](=[N:13][C@@H:5]([CH2:2][C:7](=[O:15])[OH:16])[C:10](=[N:14][C@@H:6]([CH2:3][C:8](=[O:17])[OH:18])[C:11](=[O:21])[OH:22])[OH:20])[OH:19])[NH2:12]

Parent-child relations graph

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