Cys-Thr-Phe

Properties Image MNX_ID MNXM1124323 reference chebi:161727 formula C16H23N3O5S global charge 0 mol weight 369.443 InChIKey JTEGHEWKBCTIAL-IXOXFDKPSA-N InChI InChI=1S/C16H23N3O5S/c1-9(20)13(19-14(21)11(17)8-25)15(22)18-12(16(23)24)7-10-5-3-2-4-6-10/h2-6,9,11-13,20,25H,7-8,17H2,1H3,(H,18,22)(H,19,21)(H,23,24)/t9-,11+,12+,13+/m1/s1 SMILES C[C@@H](O)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C16H23N3O5S/c1-9(20)13(19-14(21)11(17)8-25)15(22)18-12(16(23)24)7-10-5-3-2-4-6-10/h2-6,9,11-13,20,25H,7-8,17H2,1H3,(H,18,22)(H,19,21)(H,23,24)/t9-,11+,12+,13+/m1/s1 SMILES (mnx) [CH3:1][C@H:9]([C@@H:13]([C:15](=[N:18][C@@H:12]([CH2:7][C:10]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)[C:16](=[O:23])[OH:24])[OH:22])[N:19]=[C:14]([C@H:11]([CH2:8][SH:25])[NH2:17])[OH:21])[OH:20]

Parent-child relations graph

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