Hmdb loader

Showing information for DMID00058673

Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:32 UTC
Update Date2025-03-21 18:05:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00058673
Frequency53.8
Structure
Chemical FormulaC22H26O6
Molecular Mass386.1729
SMILESCOc1cc(CCC(=O)CC(=O)CCc2ccc(O)c(OC)c2)cc(OC)c1
InChI KeySNGAUHMHTVOGPC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classdiarylheptanoids
Subclass linear diarylheptanoids
Direct Parent linear diarylheptanoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • dimethoxybenzenes
  • gingerdiones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • phenoxy compounds
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • gingerdione
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • alkyl aryl ether
  • methoxybenzene
  • ketone
  • aromatic homomonocyclic compound
  • dimethoxybenzene
  • organic oxide
  • organic oxygen compound
  • m-dimethoxybenzene
  • anisole
  • linear 1,7-diphenylheptane skeleton
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound