Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:28:02 UTC
Update Date2025-03-25 01:26:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02403975
Frequency0.5
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESCN1C2COC1C(CO)O2
InChI KeyPFUFTLVAVRTRLD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,4-dioxanes
Direct Parent 1,4-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hemiaminals
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxazolidines
  • primary alcohols
  • Substituents
  • alcohol
  • azacycle
  • hemiaminal
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • oxazolidine
  • para-dioxane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound