Tyr-Gly-Glu

Properties Image MNX_ID MNXM1127651 reference chebi:165078 formula C16H21N3O7 global charge 0 mol weight 367.358 InChIKey GIOBXJSONRQHKQ-RYUDHWBXSA-N InChI InChI=1S/C16H21N3O7/c17-11(7-9-1-3-10(20)4-2-9)15(24)18-8-13(21)19-12(16(25)26)5-6-14(22)23/h1-4,11-12,20H,5-8,17H2,(H,18,24)(H,19,21)(H,22,23)(H,25,26)/t11-,12-/m0/s1 SMILES N[C@@H](CC1=CC=C(O)C=C1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C16H21N3O7/c17-11(7-9-1-3-10(20)4-2-9)15(24)18-8-13(21)19-12(16(25)26)5-6-14(22)23/h1-4,11-12,20H,5-8,17H2,(H,18,24)(H,19,21)(H,22,23)(H,25,26)/t11-,12-/m0/s1 SMILES (mnx) [CH:1]1=[CH:3][C:10]([OH:20])=[CH:4][CH:2]=[C:9]1[CH2:7][C@@H:11]([C:15](=[N:18][CH2:8][C:13](=[N:19][C@@H:12]([CH2:5][CH2:6][C:14](=[O:22])[OH:23])[C:16](=[O:25])[OH:26])[OH:21])[OH:24])[NH2:17]

Parent-child relations graph

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