Asn-Asp-Ala

Properties Image MNX_ID MNXM1122204 reference chebi:159595 formula C11H18N4O7 global charge 0 mol weight 318.286 InChIKey KXEGPPNPXOKKHK-ZLUOBGJFSA-N InChI InChI=1S/C11H18N4O7/c1-4(11(21)22)14-10(20)6(3-8(17)18)15-9(19)5(12)2-7(13)16/h4-6H,2-3,12H2,1H3,(H2,13,16)(H,14,20)(H,15,19)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1 SMILES C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O MNX internals InChI (mnx) InChI=1/C11H18N4O7/c1-4(11(21)22)14-10(20)6(3-8(17)18)15-9(19)5(12)2-7(13)16/h4-6H,2-3,12H2,1H3,(H2,13,16)(H,14,20)(H,15,19)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1 SMILES (mnx) [CH3:1][C@@H:4]([C:11](=[O:21])[OH:22])[N:14]=[C:10]([C@H:6]([CH2:3][C:8](=[O:17])[OH:18])[N:15]=[C:9]([C@H:5]([CH2:2][C:7](=[NH:13])[OH:16])[NH2:12])[OH:19])[OH:20]

Parent-child relations graph

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