Hmdb loader

Showing information for DMID02117836

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:23:35 UTC
Update Date2025-03-25 00:40:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02117836
Frequency0.6
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESC[N+]([O-])=C1C=CCC1(C)C
InChI KeyAZBFKVTUWYNFTD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass imines
Direct Parent secondary ketimines
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • nitrones
  • organic oxides
  • organic oxoanionic compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • allyl-type 1,3-dipolar organic compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • secondary ketimine
  • organic oxide
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic hyponitrite
  • nitrone