Hmdb loader
Record Information
HMDB Statusquantified
Creation Date2024-02-20 23:34:06 UTC
Update Date2025-03-21 17:56:30 UTC
HMDB IDHMDB0006478
Metabolite Identification
DeepMet IDDMID00001706
NameIsovaleraldehyde
Frequency3522.0
Structure
Chemical FormulaC5H10O
Molecular Mass86.0732
SMILESCC(C)CC=O
InChI KeyYGHRJJRRZDOVPD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • short-chain aldehydes
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • short-chain aldehyde
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative