Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:10 UTC
Update Date2025-03-21 18:41:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134438
Frequency18.7
Structure
Chemical FormulaC6H10O5
Molecular Mass162.0528
SMILESO=CC1(O)CC(O)C(O)CO1
InChI KeyLBJWYRASHSNTEP-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
  • 1,2-diols
  • aldehydes
  • hemiacetals
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • pyrans
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • pyran carboxylic acid or derivatives
  • aldehyde
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organooxygen compound
  • 1,2-diol