Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:38:44 UTC
Update Date2025-03-21 17:58:09 UTC
HMDB IDHMDB0035072
Metabolite Identification
DeepMet IDDMID00012566
Name2-Methylpropyl 2-aminobenzoate
Frequency360.7
Structure
Chemical FormulaC11H15NO2
Molecular Mass193.1103
SMILESCC(C)COC(=O)c1ccccc1N
InChI KeyILCLJQFCMRCPNM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent benzoic acid esters
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • benzoyl derivatives
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • amino acid or derivatives
  • benzoyl
  • benzoate ester
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound