compound 0285642

Properties Image MNX_ID MNXM1177618 reference envipathM:...82efce8d270a formula C7H6O6S global charge -2 mol weight 218.186 InChIKey MYLFTZGYQNBLLC-ZUVMSYQZSA-L InChI InChI=1S/C7H8O6S/c1-14(12,13)5(7(10)11)3-2-4-6(8)9/h2-4H,1H3,(H,8,9)(H,10,11)/p-2/b4-2+,5-3+ SMILES CS(=O)(=O)/C(=C/C=C/C(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H8O6S/c1-14(12,13)5(7(10)11)3-2-4-6(8)9/h2-4H,1H3,(H,8,9)(H,10,11)/b4-2+,5-3+ SMILES (mnx) [CH3:1][S:14](/[C:5](=[CH:3]/[CH:2]=[CH:4]/[C:6](=[O:8])[OH:9])[C:7](=[O:10])[OH:11])(=[O:12])=[O:13]

Parent-child relations graph

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