Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:41:22 UTC
Update Date2025-03-21 17:59:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00018359
Frequency225.7
Structure
Chemical FormulaC5H13NO
Molecular Mass103.0997
SMILESCNC(C)C(C)O
InChI KeyZRHCPNAOHVNUKM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine