Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:21 UTC
Update Date2025-03-21 18:39:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125471
Frequency20.4
Structure
Chemical FormulaC5H6O5
Molecular Mass146.0215
SMILESO=C1CC(C(=O)O)C(O)O1
InChI KeyGMFOJWDJVIBPBX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • gamma butyrolactones
  • hemiacetals
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • carboxylic acid
  • tetrahydrofuran
  • carboxylic acid derivative
  • gamma butyrolactone
  • lactone
  • oxacycle
  • beta-hydroxy acid
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • dicarboxylic acid or derivatives
  • hemiacetal
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound