Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:38 UTC
Update Date2025-03-21 18:40:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00130974
Frequency19.3
Structure
Chemical FormulaC12H17NO
Molecular Mass191.131
SMILESCc1ccc(C)c(CCC(N)=O)c1C
InChI KeyWMMYJDQRDLCHGL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • fatty amide
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound