Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:07:21 UTC
Update Date2025-03-21 18:29:51 UTC
HMDB IDHMDB0031504
Metabolite Identification
DeepMet IDDMID00079858
NameMethyl (Z)-3-hexenoate
Frequency36.5
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCCC=CCC(=O)OC
InChI KeyXEAIHUDTEINXFG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid methyl esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • fatty acid methyl ester
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound