Ala-Glu-Gln

Properties Image MNX_ID MNXM1120759 reference chebi:158141 formula C13H22N4O7 global charge 0 mol weight 346.34 InChIKey BGNLUHXLSAQYRQ-FXQIFTODSA-N InChI InChI=1S/C13H22N4O7/c1-6(14)11(21)16-7(3-5-10(19)20)12(22)17-8(13(23)24)2-4-9(15)18/h6-8H,2-5,14H2,1H3,(H2,15,18)(H,16,21)(H,17,22)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1 SMILES C[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O MNX internals InChI (mnx) InChI=1/C13H22N4O7/c1-6(14)11(21)16-7(3-5-10(19)20)12(22)17-8(13(23)24)2-4-9(15)18/h6-8H,2-5,14H2,1H3,(H2,15,18)(H,16,21)(H,17,22)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1 SMILES (mnx) [CH3:1][C@@H:6]([C:11](=[N:16][C@@H:7]([CH2:3][CH2:5][C:10](=[O:19])[OH:20])[C:12](=[N:17][C@@H:8]([CH2:2][CH2:4][C:9](=[NH:15])[OH:18])[C:13](=[O:23])[OH:24])[OH:22])[OH:21])[NH2:14]

Parent-child relations graph

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