(2R)-2-acetamido-3-(3,7,11-trimethyldodeca-2,6,10-trienylthio)propanoic acid

Properties Image MNX_ID MNXM1108398 reference chebi:94750 formula C20H33NO3S global charge 0 mol weight 367.555 InChIKey XTURYZYJYQRJDO-IBGZPJMESA-N InChI InChI=1S/C20H33NO3S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-25-14-19(20(23)24)21-18(5)22/h8,10,12,19H,6-7,9,11,13-14H2,1-5H3,(H,21,22)(H,23,24)/t19-/m0/s1 SMILES CC(=O)N[C@@H](CSCC=C(C)CCC=C(C)CCC=C(C)C)C(=O)O MNX internals InChI (mnx) InChI=1/C20H33NO3S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-25-14-19(20(23)24)21-18(5)22/h8,10,12,19H,6-7,9,11,13-14H2,1-5H3,(H,21,22)(H,23,24)/b16-10?,17-12?/t19-/m0/s1 SMILES (mnx) [CH3:1][C:15]([CH3:2])=[CH:8][CH2:6][CH2:9][C:16]([CH3:3])=[CH:10][CH2:7][CH2:11][C:17]([CH3:4])=[CH:12][CH2:13][S:25][CH2:14][C@@H:19]([C:20](=[O:23])[OH:24])[N:21]=[C:18]([CH3:5])[OH:22]

Parent-child relations graph

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