Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:35:49 UTC
Update Date2025-03-24 13:58:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00712424
Frequency2.2
Structure
Chemical FormulaC5H6O4
Molecular Mass130.0266
SMILESO=C(O)C1(O)C=CCO1
InChI KeyDQHROPYWKPTZFQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dihydrofurans
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • dihydrofuran