Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:52:29 UTC
Update Date2025-03-21 22:59:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00610092
Frequency2.6
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCC1OC(=O)CCC1=O
InChI KeyZBSCLGSVVUOWLM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass delta valerolactones
Direct Parent delta valerolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha-acyloxy ketones
  • carboxylic acid esters
  • cyclic ketones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • Substituents
  • carbonyl group
  • alpha-acyloxy ketone
  • delta valerolactone
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • oxane
  • delta_valerolactone
  • organooxygen compound