Ala-Tyr-Glu

Properties Image MNX_ID MNXM1121226 reference chebi:158613 formula C17H23N3O7 global charge 0 mol weight 381.385 InChIKey BGGAIXWIZCIFSG-XDTLVQLUSA-N InChI InChI=1S/C17H23N3O7/c1-9(18)15(24)20-13(8-10-2-4-11(21)5-3-10)16(25)19-12(17(26)27)6-7-14(22)23/h2-5,9,12-13,21H,6-8,18H2,1H3,(H,19,25)(H,20,24)(H,22,23)(H,26,27)/t9-,12-,13-/m0/s1 SMILES C[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C17H23N3O7/c1-9(18)15(24)20-13(8-10-2-4-11(21)5-3-10)16(25)19-12(17(26)27)6-7-14(22)23/h2-5,9,12-13,21H,6-8,18H2,1H3,(H,19,25)(H,20,24)(H,22,23)(H,26,27)/t9-,12-,13-/m0/s1 SMILES (mnx) [CH3:1][C@@H:9]([C:15](=[N:20][C@@H:13]([CH2:8][C:10]1=[CH:3][CH:5]=[C:11]([OH:21])[CH:4]=[CH:2]1)[C:16](=[N:19][C@@H:12]([CH2:6][CH2:7][C:14](=[O:22])[OH:23])[C:17](=[O:26])[OH:27])[OH:25])[OH:24])[NH2:18]

Parent-child relations graph

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