Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:46 UTC
Update Date2025-03-21 18:39:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124100
Frequency20.7
Structure
Chemical FormulaC6H10O4
Molecular Mass146.0579
SMILESO=C1C(O)CCC(O)C1O
InChI KeyPGEMDPFATWKLOT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclitols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclitol or derivatives
  • cyclic ketone
  • ketone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative