Molecule ID: 189003

IUPAC Name: 3,4-dihydroxybenzenesulfonic acid

Description: The molecule is a benzene ring substituted with a sulphonic acid group at position C-1, and hydroxy groups at C-3 and C-4. It has a role as a metabolite. It is a conjugate acid of a 3,4-dihydroxybenzenesulfonate.

SMILES: O=S(=O)(O)c1ccc(O)c(O)c1

SELFIES: [O][=S][=Branch1][C][=O][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2]

InChI: InChI=1S/C6H6O5S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3,7-8H,(H,9,10,11)

Molecular Properties:
- Polar Surface Area: 103.0 Ų
- LogP: 0.6