2-carboxyethyl-CoM

Properties Image MNX_ID MNXM163651 reference metacycM:CPD-19008 formula C4H6O5S2 global charge -2 mol weight 198.221 InChIKey BMVIOTAEQYMCSL-UHFFFAOYSA-L InChI InChI=1S/C4H8O5S2/c5-4(6)3-10-1-2-11(7,8)9/h1-3H2,(H,5,6)(H,7,8,9)/p-2 SMILES O=C([O-])CSCCS(=O)(=O)[O-] MNX internals InChI (mnx) InChI=1/C4H8O5S2/c5-4(6)3-10-1-2-11(7,8)9/h1-3H2,(H,5,6)(H,7,8,9) SMILES (mnx) [CH2:1]([CH2:2][S:11]([OH:7])(=[O:8])=[O:9])[S:10][CH2:3][C:4](=[O:5])[OH:6]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0