Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:54 UTC
Update Date2025-03-21 18:02:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040678
Frequency84.8
Structure
Chemical FormulaC9H15NO3
Molecular Mass185.1052
SMILESNC(=O)CCCCC1CCC(=O)O1
InChI KeyVDNAUTBKBKDLFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • fatty amides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary carboxylic acid amides
  • tetrahydrofurans
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • carbonyl group
  • tetrahydrofuran
  • fatty amide
  • carboxamide group
  • carboxylic acid derivative
  • gamma butyrolactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound