Tyrosyl-Threonine

Properties Image MNX_ID MNXM744967 reference biggM:tyrthr formula C13H18N2O5 global charge 0 mol weight 282.296 InChIKey MFEVVAXTBZELLL-ONOSFVFSSA-N InChI InChI=1S/C13H18N2O5/c1-7(16)11(13(19)20)15-12(18)10(14)6-8-2-4-9(17)5-3-8/h2-5,7,10-11,16-17H,6,14H2,1H3,(H,15,18)(H,19,20)/t7-,10-,11+/m1/s1 SMILES C[C@@H](O)[C@H](NC(=O)[C@H](N)CC1=CC=C(O)C=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C13H18N2O5/c1-7(16)11(13(19)20)15-12(18)10(14)6-8-2-4-9(17)5-3-8/h2-5,7,10-11,16-17H,6,14H2,1H3,(H,15,18)(H,19,20)/t7-,10-,11+/m1/s1 SMILES (mnx) [CH3:1][C@H:7]([C@@H:11]([C:13](=[O:19])[OH:20])[N:15]=[C:12]([C@@H:10]([CH2:6][C:8]1=[CH:3][CH:5]=[C:9]([OH:17])[CH:4]=[CH:2]1)[NH2:14])[OH:18])[OH:16]

Parent-child relations graph

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