Hmdb loader

Showing information for DMID00013186

Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:00 UTC
Update Date2025-03-21 17:58:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00013186
Frequency340.8
Structure
Chemical FormulaC7H10O
Molecular Mass110.0732
SMILESC=C(C)C(=O)C=CC
InChI KeyGATZTNGEYJDPIG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-branched alpha,beta-unsaturated ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
    • Substituents
  • ketone
  • alpha-branched alpha,beta-unsaturated-ketone
  • aliphatic acyclic compound
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • enone