Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:00 UTC
Update Date2025-03-25 00:57:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226614
Frequency0.5
Structure
Chemical FormulaC10H16O3
Molecular Mass184.1099
SMILESCC1(C)C2CCC1OC(C(=O)O)C2
InChI KeyHHDKSQIVDFIXFH-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
  • oxepanes
  • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • pyran carboxylic acid or derivatives
  • carboxylic acid derivative
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • oxane
  • organooxygen compound