Leu-Glu-Glu

Properties Image MNX_ID MNXM1121774 reference chebi:159163 formula C16H27N3O8 global charge 0 mol weight 389.405 InChIKey WIDZHJTYKYBLSR-DCAQKATOSA-N InChI InChI=1S/C16H27N3O8/c1-8(2)7-9(17)14(24)18-10(3-5-12(20)21)15(25)19-11(16(26)27)4-6-13(22)23/h8-11H,3-7,17H2,1-2H3,(H,18,24)(H,19,25)(H,20,21)(H,22,23)(H,26,27)/t9-,10-,11-/m0/s1 SMILES CC(C)C[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C16H27N3O8/c1-8(2)7-9(17)14(24)18-10(3-5-12(20)21)15(25)19-11(16(26)27)4-6-13(22)23/h8-11H,3-7,17H2,1-2H3,(H,18,24)(H,19,25)(H,20,21)(H,22,23)(H,26,27)/t9-,10-,11-/m0/s1 SMILES (mnx) [CH3:1][CH:8]([CH3:2])[CH2:7][C@@H:9]([C:14](=[N:18][C@@H:10]([CH2:3][CH2:5][C:12](=[O:20])[OH:21])[C:15](=[N:19][C@@H:11]([CH2:4][CH2:6][C:13](=[O:22])[OH:23])[C:16](=[O:26])[OH:27])[OH:25])[OH:24])[NH2:17]

Parent-child relations graph

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