Hmdb loader

Showing information for DMID02235844

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:06 UTC
Update Date2025-03-25 00:59:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235844
Frequency0.5
Structure
Chemical FormulaC25H30O11
Molecular Mass506.1788
SMILESCOc1cc(CCC(=O)CCc2ccc(OC3C(O)OC(C(=O)O)C(O)C3O)c(OC)c2)ccc1O
InChI KeyDUMNZUYNOHQDHZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass methoxyphenols
Direct Parent paradols
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • beta hydroxy acids and derivatives
  • carboxylic acids
  • glucuronic acid derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • ketones
  • methoxybenzenes
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • pyran carboxylic acids
  • secondary alcohols
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • glucuronic acid or derivatives
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • alkyl aryl ether
  • carboxylic acid derivative
  • pyran carboxylic acid
  • ketone
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • hemiacetal
  • oxane
  • organoheterocyclic compound
  • 1,2-diol
  • alcohol
  • pyran carboxylic acid or derivatives
  • hydroxy acid
  • methoxybenzene
  • paradol
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound