Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:15 UTC
Update Date2025-03-25 00:46:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156352
Frequency0.5
Structure
Chemical FormulaC6H11NO
Molecular Mass113.0841
SMILESC[N+]1([O-])CC=CCC1
InChI KeyUHMWMTXBOBUXRV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass aminoxides
Direct Parent trialkyl amine oxides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic oxoanionic compounds
  • organopnictogen compounds
  • trisubstituted amine oxides and derivatives
  • Substituents
  • azacycle
  • n-oxide
  • trialkyl amine oxide
  • organic oxide
  • organic oxygen compound
  • trisubstituted n-oxide
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organic hyponitrite