Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:26:03 UTC
Update Date2025-03-24 20:19:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01409455
Frequency0.9
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCC(C)C(N)c1ccco1
InChI KeyPXVNXKHDHZIQNP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • furan
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound