Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:02:41 UTC
Update Date2025-03-25 01:41:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02485557
Frequency0.5
Structure
Chemical FormulaC6H8O4
Molecular Mass144.0423
SMILESO=C(O)CC1OC2CC1O2
InChI KeyFQKJMKKNSPRHHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxolanes
Subclass 1,3-dioxolanes
Direct Parent 1,3-dioxolanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxetanes
  • tetrahydrofurans
  • Substituents
  • meta-dioxolane
  • carbonyl group
  • carboxylic acid
  • tetrahydrofuran
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acetal
  • oxetane
  • hydrocarbon derivative
  • organooxygen compound