Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:40:38 UTC
Update Date2025-03-21 17:58:47 UTC
HMDB IDHMDB0031562
Metabolite Identification
DeepMet IDDMID00016761
Name2-Methyl-3-pentenoic acid
Frequency253.9
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESCC=CC(C)C(=O)O
InChI KeyNFRJJFMXYKSRPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent methyl-branched fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound