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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:51 UTC
Update Date2025-03-25 00:49:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175858
Frequency0.5
Structure
Chemical FormulaC17H22O4
Molecular Mass290.1518
SMILESCC1=C(O)C(=O)OC1(C)Cc1c(C)c(C)c(O)c(C)c1C
InChI KeyAVDSLCYVGBKHLZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass cresols
Direct Parent meta cresols
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • butenolides
  • carbonyl compounds
  • dihydrofurans
  • enoate esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • ortho cresols
  • oxacyclic compounds
  • phenols
    • Substituents
  • enoate ester
  • monocyclic benzene moiety
  • carbonyl group
  • m-cresol
  • aromatic heteromonocyclic compound
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • alpha,beta-unsaturated carboxylic ester
  • 2-furanone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • o-cresol
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • dihydrofuran