Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:42:01 UTC
Update Date2025-03-21 21:55:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00442871
Frequency4.0
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCCC=C(O)C(O)=C=O
InChI KeyWJJDWWTTYWBKRI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • hydrocarbon derivative