Phe-Met-Phe

Properties Image MNX_ID MNXM1124334 reference chebi:161738 formula C23H29N3O4S global charge 0 mol weight 443.569 InChIKey OHIYMVFLQXTZAW-UFYCRDLUSA-N InChI InChI=1S/C23H29N3O4S/c1-31-13-12-19(25-21(27)18(24)14-16-8-4-2-5-9-16)22(28)26-20(23(29)30)15-17-10-6-3-7-11-17/h2-11,18-20H,12-15,24H2,1H3,(H,25,27)(H,26,28)(H,29,30)/t18-,19-,20-/m0/s1 SMILES CSCC[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C23H29N3O4S/c1-31-13-12-19(25-21(27)18(24)14-16-8-4-2-5-9-16)22(28)26-20(23(29)30)15-17-10-6-3-7-11-17/h2-11,18-20H,12-15,24H2,1H3,(H,25,27)(H,26,28)(H,29,30)/t18-,19-,20-/m0/s1 SMILES (mnx) [CH3:1][S:31][CH2:13][CH2:12][C@@H:19]([C:22](=[N:26][C@@H:20]([CH2:15][C:17]1=[CH:10][CH:6]=[CH:3][CH:7]=[CH:11]1)[C:23](=[O:29])[OH:30])[OH:28])[N:25]=[C:21]([C@H:18]([CH2:14][C:16]1=[CH:8][CH:4]=[CH:2][CH:5]=[CH:9]1)[NH2:24])[OH:27]

Parent-child relations graph

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