Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:35:42 UTC
Update Date2025-03-24 14:29:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00856627
Frequency1.7
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESC=C=C(O)C(=O)CCCC
InChI KeyIUGYSWOYXYXXAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydroxy ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • enones
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • alpha-hydroxy ketone
  • enone