Asn-Ala-Gln

Properties Image MNX_ID MNXM1122095 reference chebi:159484 formula C12H21N5O6 global charge 0 mol weight 331.329 InChIKey PDQBXRSOSCTGKY-ACZMJKKPSA-N InChI InChI=1S/C12H21N5O6/c1-5(16-11(21)6(13)4-9(15)19)10(20)17-7(12(22)23)2-3-8(14)18/h5-7H,2-4,13H2,1H3,(H2,14,18)(H2,15,19)(H,16,21)(H,17,20)(H,22,23)/t5-,6-,7-/m0/s1 SMILES C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O MNX internals InChI (mnx) InChI=1/C12H21N5O6/c1-5(16-11(21)6(13)4-9(15)19)10(20)17-7(12(22)23)2-3-8(14)18/h5-7H,2-4,13H2,1H3,(H2,14,18)(H2,15,19)(H,16,21)(H,17,20)(H,22,23)/t5-,6-,7-/m0/s1 SMILES (mnx) [CH3:1][C@@H:5]([C:10](=[N:17][C@@H:7]([CH2:2][CH2:3][C:8](=[NH:14])[OH:18])[C:12](=[O:22])[OH:23])[OH:20])[N:16]=[C:11]([C@H:6]([CH2:4][C:9](=[NH:15])[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