Asp-Glu-Ile

Properties Image MNX_ID MNXM1123131 reference chebi:160531 formula C15H25N3O8 global charge 0 mol weight 375.378 InChIKey VILLWIDTHYPSLC-PEFMBERDSA-N InChI InChI=1S/C15H25N3O8/c1-3-7(2)12(15(25)26)18-14(24)9(4-5-10(19)20)17-13(23)8(16)6-11(21)22/h7-9,12H,3-6,16H2,1-2H3,(H,17,23)(H,18,24)(H,19,20)(H,21,22)(H,25,26)/t7-,8-,9-,12-/m0/s1 SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C15H25N3O8/c1-3-7(2)12(15(25)26)18-14(24)9(4-5-10(19)20)17-13(23)8(16)6-11(21)22/h7-9,12H,3-6,16H2,1-2H3,(H,17,23)(H,18,24)(H,19,20)(H,21,22)(H,25,26)/t7-,8-,9-,12-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][C@H:7]([CH3:2])[C@@H:12]([C:15](=[O:25])[OH:26])[N:18]=[C:14]([C@H:9]([CH2:4][CH2:5][C:10](=[O:19])[OH:20])[N:17]=[C:13]([C@H:8]([CH2:6][C:11](=[O:21])[OH:22])[NH2:16])[OH:23])[OH:24]

Parent-child relations graph

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