Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:15:50 UTC
Update Date2025-03-24 21:33:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01815493
Frequency0.7
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESNC1C(O)CC2CC1C2
InChI KeyBPRSIGXJTMTRHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • cyclic alcohol
  • aliphatic homopolycyclic compound