Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:51:20 UTC
Update Date2025-03-21 18:03:01 UTC
HMDB IDHMDB0253165
Metabolite Identification
DeepMet IDDMID00041723
NameHexyl acrylate
Frequency82.2
Structure
Chemical FormulaC9H16O2
Molecular Mass156.115
SMILESC=CC(=O)OCCCCCC
InChI KeyLNMQRPPRQDGUDR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent enoate esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • enoate ester
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound