Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:14 UTC
Update Date2025-03-25 00:58:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231530
Frequency0.5
Structure
Chemical FormulaC12H20O2
Molecular Mass196.1463
SMILESCC=C(C)CCCCCCC(O)=C=O
InChI KeyFJPHCDCAUFGUHA-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