Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:53:24 UTC
Update Date2025-03-25 01:37:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02463356
Frequency0.5
Structure
Chemical FormulaC6H9NO2-
Molecular Mass127.0639
SMILESCC=CC(C)=C[N+]([O-])[O-]
InChI KeyQRYIETJYIGRAMF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoanionic compounds
Subclass organic oxoanionic compounds
Direct Parent organic oxoanionic compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic anions
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic anion
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic hyponitrite