Asn-Ile-Ala

Properties Image MNX_ID MNXM1122442 reference chebi:159835 formula C13H24N4O5 global charge 0 mol weight 316.358 InChIKey NKLRWRRVYGQNIH-GHCJXIJMSA-N InChI InChI=1S/C13H24N4O5/c1-4-6(2)10(12(20)16-7(3)13(21)22)17-11(19)8(14)5-9(15)18/h6-8,10H,4-5,14H2,1-3H3,(H2,15,18)(H,16,20)(H,17,19)(H,21,22)/t6-,7-,8-,10-/m0/s1 SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](C)C(=O)O MNX internals InChI (mnx) InChI=1/C13H24N4O5/c1-4-6(2)10(12(20)16-7(3)13(21)22)17-11(19)8(14)5-9(15)18/h6-8,10H,4-5,14H2,1-3H3,(H2,15,18)(H,16,20)(H,17,19)(H,21,22)/t6-,7-,8-,10-/m0/s1 SMILES (mnx) [CH3:1][CH2:4][C@H:6]([CH3:2])[C@@H:10]([C:12](=[N:16][C@@H:7]([CH3:3])[C:13](=[O:21])[OH:22])[OH:20])[N:17]=[C:11]([C@H:8]([CH2:5][C:9](=[NH:15])[OH:18])[NH2:14])[OH:19]

Parent-child relations graph

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