Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:34:11 UTC
Update Date2025-03-24 17:52:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00996522
Frequency1.4
Structure
Chemical FormulaC4H11NO2
Molecular Mass105.079
SMILESCC(C)(O)C(N)O
InChI KeyAMLKQRMSPBTKTN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hemiaminals
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • hemiaminal
  • tertiary alcohol
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkanolamine