Leu-Phe-Met

Properties Image MNX_ID MNXM1122038 reference chebi:159427 formula C20H31N3O4S global charge 0 mol weight 409.552 InChIKey WXDRGWBQZIMJDE-ULQDDVLXSA-N InChI InChI=1S/C20H31N3O4S/c1-13(2)11-15(21)18(24)23-17(12-14-7-5-4-6-8-14)19(25)22-16(20(26)27)9-10-28-3/h4-8,13,15-17H,9-12,21H2,1-3H3,(H,22,25)(H,23,24)(H,26,27)/t15-,16-,17-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CC(C)C)C(=O)O MNX internals InChI (mnx) InChI=1/C20H31N3O4S/c1-13(2)11-15(21)18(24)23-17(12-14-7-5-4-6-8-14)19(25)22-16(20(26)27)9-10-28-3/h4-8,13,15-17H,9-12,21H2,1-3H3,(H,22,25)(H,23,24)(H,26,27)/t15-,16-,17-/m0/s1 SMILES (mnx) [CH3:1][CH:13]([CH3:2])[CH2:11][C@@H:15]([C:18](=[N:23][C@@H:17]([CH2:12][C:14]1=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]1)[C:19](=[N:22][C@@H:16]([CH2:9][CH2:10][S:28][CH3:3])[C:20](=[O:26])[OH:27])[OH:25])[OH:24])[NH2:21]

Parent-child relations graph

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