Cys-Asp-Phe

Properties Image MNX_ID MNXM1123808 reference chebi:161210 formula C16H21N3O6S global charge 0 mol weight 383.426 InChIKey IIGHQOPGMGKDMT-SRVKXCTJSA-N InChI InChI=1S/C16H21N3O6S/c17-10(8-26)14(22)18-11(7-13(20)21)15(23)19-12(16(24)25)6-9-4-2-1-3-5-9/h1-5,10-12,26H,6-8,17H2,(H,18,22)(H,19,23)(H,20,21)(H,24,25)/t10-,11-,12-/m0/s1 SMILES N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C16H21N3O6S/c17-10(8-26)14(22)18-11(7-13(20)21)15(23)19-12(16(24)25)6-9-4-2-1-3-5-9/h1-5,10-12,26H,6-8,17H2,(H,18,22)(H,19,23)(H,20,21)(H,24,25)/t10-,11-,12-/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:9]([CH2:6][C@@H:12]([C:16](=[O:24])[OH:25])[N:19]=[C:15]([C@H:11]([CH2:7][C:13](=[O:20])[OH:21])[N:18]=[C:14]([C@H:10]([CH2:8][SH:26])[NH2:17])[OH:22])[OH:23])[CH:5]=[CH:3]1

Parent-child relations graph

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