Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:02:41 UTC
Update Date2025-03-21 20:11:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00349315
Frequency5.4
Structure
Chemical FormulaC6H11NO2
Molecular Mass129.079
SMILESNC1C=CCC(O)C1O
InChI KeyCDNHBELCIPLBAM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,2-diol