Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:01 UTC
Update Date2025-03-25 00:56:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02219885
Frequency0.5
Structure
Chemical FormulaC19H24O3
Molecular Mass300.1725
SMILESCc1cc(CC(C)C(CO)Cc2cccc(O)c2)ccc1O
InChI KeyLOLREVLSHUSOKJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
Classdibenzylbutane lignans
Subclass dibenzylbutane lignans
Direct Parent dibenzylbutane lignans
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • ortho cresols
  • phenylpropanes
  • primary alcohols
  • toluenes
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • dibenzylbutane lignan skeleton
  • organic oxygen compound
  • o-cresol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary alcohol
  • toluene
  • organooxygen compound