Met-Met-Phe

Properties Image MNX_ID MNXM1123551 reference chebi:160952 formula C19H29N3O4S2 global charge 0 mol weight 427.592 InChIKey CNTNPWWHFWAZGA-JYJNAYRXSA-N InChI InChI=1S/C19H29N3O4S2/c1-27-10-8-14(20)17(23)21-15(9-11-28-2)18(24)22-16(19(25)26)12-13-6-4-3-5-7-13/h3-7,14-16H,8-12,20H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)/t14-,15-,16-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C19H29N3O4S2/c1-27-10-8-14(20)17(23)21-15(9-11-28-2)18(24)22-16(19(25)26)12-13-6-4-3-5-7-13/h3-7,14-16H,8-12,20H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)/t14-,15-,16-/m0/s1 SMILES (mnx) [CH3:1][S:27][CH2:10][CH2:8][C@@H:14]([C:17](=[N:21][C@@H:15]([CH2:9][CH2:11][S:28][CH3:2])[C:18](=[N:22][C@@H:16]([CH2:12][C:13]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1)[C:19](=[O:25])[OH:26])[OH:24])[OH:23])[NH2:20]

Parent-child relations graph

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