Ala-Tyr-Ala

Properties Image MNX_ID MNXM1121214 reference chebi:158601 formula C15H21N3O5 global charge 0 mol weight 323.349 InChIKey AENHOIXXHKNIQL-AUTRQRHGSA-N InChI InChI=1S/C15H21N3O5/c1-8(16)13(20)18-12(14(21)17-9(2)15(22)23)7-10-3-5-11(19)6-4-10/h3-6,8-9,12,19H,7,16H2,1-2H3,(H,17,21)(H,18,20)(H,22,23)/t8-,9-,12-/m0/s1 SMILES C[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](C)C(=O)O MNX internals InChI (mnx) InChI=1/C15H21N3O5/c1-8(16)13(20)18-12(14(21)17-9(2)15(22)23)7-10-3-5-11(19)6-4-10/h3-6,8-9,12,19H,7,16H2,1-2H3,(H,17,21)(H,18,20)(H,22,23)/t8-,9-,12-/m0/s1 SMILES (mnx) [CH3:1][C@@H:8]([C:13](=[N:18][C@@H:12]([CH2:7][C:10]1=[CH:4][CH:6]=[C:11]([OH:19])[CH:5]=[CH:3]1)[C:14](=[N:17][C@@H:9]([CH3:2])[C:15](=[O:22])[OH:23])[OH:21])[OH:20])[NH2:16]

Parent-child relations graph

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