Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:30:36 UTC
Update Date2025-03-24 14:27:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00844426
Frequency1.7
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESC=C(C)C(O)C=C(C)CC
InChI KeyHGJOQHWISGRSOI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative