Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:35 UTC
Update Date2025-03-21 17:58:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00012203
Frequency373.7
Structure
Chemical FormulaC9H10O3
Molecular Mass166.063
SMILESCc1cc(C(=O)O)cc(C)c1O
InChI KeyOMNHTTWQSSUZHO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent hydroxybenzoic acid derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzoic acids
  • benzoyl derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • ortho cresols
  • phenols
  • m-xylenes
  • Substituents
  • carboxylic acid
  • m-xylene
  • benzoyl
  • carboxylic acid derivative
  • hydroxybenzoic acid
  • aromatic homomonocyclic compound
  • xylene
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • o-cresol
  • phenol
  • hydrocarbon derivative
  • benzoic acid
  • organooxygen compound