Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:34:25 UTC
Update Date2025-03-21 17:56:36 UTC
HMDB IDHMDB0030063
Metabolite Identification
DeepMet IDDMID00002441
NameBenzyl propionate
Frequency2480.8
Structure
Chemical FormulaC10H12O2
Molecular Mass164.0837
SMILESCCC(=O)OCc1ccccc1
InChI KeyVHOMAPWVLKRQAZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzyloxycarbonyls
Direct Parent benzyloxycarbonyls
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • benzyloxycarbonyl
  • carbonyl group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound