Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:21 UTC
Update Date2025-03-25 00:48:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167850
Frequency0.5
Structure
Chemical FormulaC10H18O3
Molecular Mass186.1256
SMILESCC(C)CC1CCC(C)(O)OC1=O
InChI KeyDDGKFZLGXIEHMQ-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
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • 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
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • delta_valerolactone
  • organooxygen compound