Gallic acid 3-sulfate

Properties Image MNX_ID MNXM1130013 reference hmdb:HMDB0240519 formula C7H6O8S global charge 0 mol weight 250.184 InChIKey GDGXJKFVYIFICY-UHFFFAOYSA-N InChI InChI=1S/C7H6O8S/c8-4-1-3(7(10)11)2-5(6(4)9)15-16(12,13)14/h1-2,8-9H,(H,10,11)(H,12,13,14) SMILES O=C(O)C1=CC(O)=C(O)C(OS(=O)(=O)O)=C1 MNX internals InChI (mnx) InChI=1/C7H6O8S/c8-4-1-3(7(10)11)2-5(6(4)9)15-16(12,13)14/h1-2,8-9H,(H,10,11)(H,12,13,14) SMILES (mnx) [CH:1]1=[C:3]([C:7](=[O:10])[OH:11])[CH:2]=[C:5]([O:15][S:16]([OH:12])(=[O:13])=[O:14])[C:6]([OH:9])=[C:4]1[OH:8]

Parent-child relations graph

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