Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:53:01 UTC
Update Date2025-03-21 22:59:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00611345
Frequency2.6
Structure
Chemical FormulaC5H7NO2
Molecular Mass113.0477
SMILESO=C1NC=CCC1O
InChI KeyKVZYCIMHIZNHDX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • carbonyl group
  • lactam
  • azacycle
  • tetrahydropyridine
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound