Trp-Ala-Ser

Properties Image MNX_ID MNXM1127007 reference chebi:164424 formula C17H22N4O5 global charge 0 mol weight 362.386 InChIKey AVYVKJMBNLPWRX-WFBYXXMGSA-N InChI InChI=1S/C17H22N4O5/c1-9(15(23)21-14(8-22)17(25)26)20-16(24)12(18)6-10-7-19-13-5-3-2-4-11(10)13/h2-5,7,9,12,14,19,22H,6,8,18H2,1H3,(H,20,24)(H,21,23)(H,25,26)/t9-,12-,14-/m0/s1 SMILES C[C@H](NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2)C(=O)N[C@@H](CO)C(=O)O MNX internals InChI (mnx) InChI=1/C17H22N4O5/c1-9(15(23)21-14(8-22)17(25)26)20-16(24)12(18)6-10-7-19-13-5-3-2-4-11(10)13/h2-5,7,9,12,14,19,22H,6,8,18H2,1H3,(H,20,24)(H,21,23)(H,25,26)/t9-,12-,14-/m0/s1 SMILES (mnx) [CH3:1][C@@H:9]([C:15](=[N:21][C@@H:14]([CH2:8][OH:22])[C:17](=[O:25])[OH:26])[OH:23])[N:20]=[C:16]([C@H:12]([CH2:6][C:10]1=[CH:7][NH:19][C:13]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:11]12)[NH2:18])[OH:24]

Parent-child relations graph

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