Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:07 UTC
Update Date2025-03-21 18:03:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00043617
Frequency77.9
Structure
Chemical FormulaC10H16O5
Molecular Mass216.0998
SMILESCC1C(C(=O)O)OC(C(=O)O)C(C)C1C
InChI KeyVOKBONHJHAVCLT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyran carboxylic acids and derivatives
Direct Parent pyran carboxylic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • pyran carboxylic acid or derivatives
  • carboxylic acid derivative
  • dialkyl ether
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • oxane
  • organooxygen compound