Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:42 UTC
Update Date2025-03-21 18:32:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00092483
Frequency30.3
Structure
Chemical FormulaC6H8O5
Molecular Mass160.0372
SMILESO=C(O)C1(O)CC(O)CC1=O
InChI KeyCPLHYPQTBKSLII-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclopentanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • acyloins
  • alpha hydroxy acids and derivatives
  • carboxylic acids
  • cyclic alcohols and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • cyclic ketone
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • cyclopentanol
  • ketone
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • acyloin
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative