Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:36 UTC
Update Date2025-03-21 18:37:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114210
Frequency23.1
Structure
Chemical FormulaC7H10O5
Molecular Mass174.0528
SMILESO=C(O)CC1(C(=O)O)CCCO1
InChI KeyKWOXTGLZTCIYSG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass dicarboxylic acids and derivatives
Direct Parent dicarboxylic acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • tetrahydrofuran
  • dialkyl ether
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound