Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:08:00 UTC
Update Date2025-03-21 22:10:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00504293
Frequency3.4
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESNC1CC(O)C(O)CC1=O
InChI KeyAYGRSZFAJPDWBK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • cyclic ketones
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • cyclic alcohol
  • ketone
  • organic oxide
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,2-diol