Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:09:57 UTC
Update Date2025-03-24 16:42:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00938377
Frequency1.5
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESOC1CCC2CNC2C1
InChI KeyXYQGRSFYRPWBJP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • cyclic alcohol
  • secondary amine
  • azetidine
  • aliphatic heteropolycyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • amine