Ala-Phe-Met

Properties Image MNX_ID MNXM1121040 reference chebi:158427 formula C17H25N3O4S global charge 0 mol weight 367.471 InChIKey RNHKOQHGYMTHFR-UBHSHLNASA-N InChI InChI=1S/C17H25N3O4S/c1-11(18)15(21)20-14(10-12-6-4-3-5-7-12)16(22)19-13(17(23)24)8-9-25-2/h3-7,11,13-14H,8-10,18H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)/t11-,13-,14-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C)N)C(=O)O MNX internals InChI (mnx) InChI=1/C17H25N3O4S/c1-11(18)15(21)20-14(10-12-6-4-3-5-7-12)16(22)19-13(17(23)24)8-9-25-2/h3-7,11,13-14H,8-10,18H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)/t11-,13-,14-/m0/s1 SMILES (mnx) [CH3:1][C@@H:11]([C:15](=[N:20][C@@H:14]([CH2:10][C:12]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1)[C:16](=[N:19][C@@H:13]([CH2:8][CH2:9][S:25][CH3:2])[C:17](=[O:23])[OH:24])[OH:22])[OH:21])[NH2:18]

Parent-child relations graph

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