Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:16:48 UTC
Update Date2025-03-21 19:09:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00243250
Frequency8.7
Structure
Chemical FormulaC5H11NO
Molecular Mass101.0841
SMILESC=CC(O)C(C)N
InChI KeySTWCGNZQQRMKAU-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
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound