Asparaginyl-Tyrosyl-Glycine

Properties Image MNX_ID MNXM744643 reference biggM:asntyrgly formula C15H20N4O6 global charge 0 mol weight 352.347 InChIKey YSYTWUMRHSFODC-MNOVXSKESA-N InChI InChI=1S/C15H20N4O6/c16-10(6-12(17)21)14(24)19-11(15(25)18-7-13(22)23)5-8-1-3-9(20)4-2-8/h1-4,10-11,20H,5-7,16H2,(H2,17,21)(H,18,25)(H,19,24)(H,22,23)/t10-,11+/m1/s1 SMILES NC(=O)C[C@@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)NCC(=O)O MNX internals InChI (mnx) InChI=1/C15H20N4O6/c16-10(6-12(17)21)14(24)19-11(15(25)18-7-13(22)23)5-8-1-3-9(20)4-2-8/h1-4,10-11,20H,5-7,16H2,(H2,17,21)(H,18,25)(H,19,24)(H,22,23)/t10-,11+/m1/s1 SMILES (mnx) [CH:1]1=[CH:3][C:9]([OH:20])=[CH:4][CH:2]=[C:8]1[CH2:5][C@@H:11]([C:15](=[N:18][CH2:7][C:13](=[O:22])[OH:23])[OH:25])[N:19]=[C:14]([C@@H:10]([CH2:6][C:12](=[NH:17])[OH:21])[NH2:16])[OH:24]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 3