Tyr-Trp-Ala

Properties Image MNX_ID MNXM1127958 reference chebi:165995 formula C23H26N4O5 global charge 0 mol weight 438.484 InChIKey ZYVAAYAOTVJBSS-GMVOTWDCSA-N InChI InChI=1S/C23H26N4O5/c1-13(23(31)32)26-22(30)20(11-15-12-25-19-5-3-2-4-17(15)19)27-21(29)18(24)10-14-6-8-16(28)9-7-14/h2-9,12-13,18,20,25,28H,10-11,24H2,1H3,(H,26,30)(H,27,29)(H,31,32)/t13-,18-,20-/m0/s1 SMILES C[C@H](NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C23H26N4O5/c1-13(23(31)32)26-22(30)20(11-15-12-25-19-5-3-2-4-17(15)19)27-21(29)18(24)10-14-6-8-16(28)9-7-14/h2-9,12-13,18,20,25,28H,10-11,24H2,1H3,(H,26,30)(H,27,29)(H,31,32)/t13-,18-,20-/m0/s1 SMILES (mnx) [CH3:1][C@@H:13]([C:23](=[O:31])[OH:32])[N:26]=[C:22]([C@H:20]([CH2:11][C:15]1=[CH:12][NH:25][C:19]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:17]12)[N:27]=[C:21]([C@H:18]([CH2:10][C:14]1=[CH:7][CH:9]=[C:16]([OH:28])[CH:8]=[CH:6]1)[NH2:24])[OH:29])[OH:30]

Parent-child relations graph

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