Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:08 UTC
Update Date2025-03-21 18:41:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136634
Frequency18.3
Structure
Chemical FormulaC6H11NO2
Molecular Mass129.079
SMILESNCC1CCCC(=O)O1
InChI KeyHLRXTLPCQKTKNK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass delta valerolactones
Direct Parent delta valerolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • Substituents
  • carbonyl group
  • delta valerolactone
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • oxane
  • delta_valerolactone
  • organooxygen compound