Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:12 UTC
Update Date2025-03-25 00:46:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153964
Frequency0.5
Structure
Chemical FormulaC11H12N2O2
Molecular Mass204.0899
SMILESCOc1cccc(C2=NNC(=O)CC2)c1
InChI KeyIPNCBWQSIIAJGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • pyridazinones
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • aromatic heteromonocyclic compound
  • azacycle
  • alkyl aryl ether
  • carboxylic acid derivative
  • methoxybenzene
  • organic oxide
  • organic oxygen compound
  • anisole
  • pyridazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • pyridazinone
  • organic nitrogen compound
  • phenoxy compound
  • organoheterocyclic compound
  • organooxygen compound