Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:43 UTC
Update Date2025-03-25 01:00:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241747
Frequency0.5
Structure
Chemical FormulaC10H16O3
Molecular Mass184.1099
SMILESCC1(C(=O)O)OC2CCC1C2(C)C
InChI KeyLDHOBYCSMRBGAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyran carboxylic acids and derivatives
Direct Parent pyran carboxylic acids
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • pyran carboxylic acid or derivatives
  • tetrahydrofuran
  • carboxylic acid derivative
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • oxane
  • organooxygen compound