CMDBS000002: 5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid

Name
5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid
Molecular Formula
C7H8O4
Molecular Weight
156.14
Exact Mass
156.042259
SMILES
C1=CC(C(C(=C1)C(=O)O)O)O
InChIKey
INCSWYKICIYAHB-UHFFFAOYSA-N
InChI
InChI=1S/C7H8O4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,5-6,8-9H,(H,10,11)
Original Database
pubchem_3
Other Databases
NA
2D&3D Structure
Classification (data sourced from ClassyFire)
  • kingdom  Organic compounds
  •        superclass  Organic acids and derivatives
  •               class  Hydroxy acids and derivatives
  •                      subclass  Beta hydroxy acids and derivatives
  •                                    direct_parent  Beta hydroxy acids and derivatives
Related predicted(in silico) Spectrum

positive

negative