Met-Phe-Glu

Properties Image MNX_ID MNXM1123576 reference chebi:160977 formula C19H27N3O6S global charge 0 mol weight 425.507 InChIKey FBLBCGLSRXBANI-KKUMJFAQSA-N InChI InChI=1S/C19H27N3O6S/c1-29-10-9-13(20)17(25)22-15(11-12-5-3-2-4-6-12)18(26)21-14(19(27)28)7-8-16(23)24/h2-6,13-15H,7-11,20H2,1H3,(H,21,26)(H,22,25)(H,23,24)(H,27,28)/t13-,14-,15-/m0/s1 SMILES CSCC[C@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C19H27N3O6S/c1-29-10-9-13(20)17(25)22-15(11-12-5-3-2-4-6-12)18(26)21-14(19(27)28)7-8-16(23)24/h2-6,13-15H,7-11,20H2,1H3,(H,21,26)(H,22,25)(H,23,24)(H,27,28)/t13-,14-,15-/m0/s1 SMILES (mnx) [CH3:1][S:29][CH2:10][CH2:9][C@@H:13]([C:17](=[N:22][C@@H:15]([CH2:11][C:12]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)[C:18](=[N:21][C@@H:14]([CH2:7][CH2:8][C:16](=[O:23])[OH:24])[C:19](=[O:27])[OH:28])[OH:26])[OH:25])[NH2:20]

Parent-child relations graph

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