Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:17:48 UTC
Update Date2025-03-25 01:22:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02380151
Frequency0.5
Structure
Chemical FormulaC6H9NO2
Molecular Mass127.0633
SMILESO=C(O)C1CC1C1CN1
InChI KeyVYHIZWZQVAVREW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass cyclopropanecarboxylic acids and derivatives
Direct Parent cyclopropanecarboxylic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • aziridines
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • azacycle
  • amino acid or derivatives
  • amino acid
  • secondary amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • cyclopropanecarboxylic acid
  • aziridine
  • organoheterocyclic compound
  • organooxygen compound
  • amine