Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:28:59 UTC
Update Date2025-03-21 20:57:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00411620
Frequency4.4
Structure
Chemical FormulaC4H7NO3
Molecular Mass117.0426
SMILESOCC1N=CC(O)O1
InChI KeyPBAGTMBETDRJAQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass oxazolines
Direct Parent oxazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hemiacetals
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • alcohol
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • oxazoline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound