Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:55 UTC
Update Date2025-03-25 00:56:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02217332
Frequency0.5
Structure
Chemical FormulaC14H31NO2
Molecular Mass245.2355
SMILESCCCCC(CC)COCC(O)CNC(C)C
InChI KeyWZXWOOVYNASLSC-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
  • dialkyl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • ether
  • secondary amine
  • dialkyl ether
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine