Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:47:59 UTC
Update Date2025-03-25 00:25:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01318321
Frequency1.0
Structure
Chemical FormulaC4H6N2O2
Molecular Mass114.0429
SMILESNC(=O)C1=NCCO1
InChI KeyHUPHGMKBBSQNKV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass oxazolines
Direct Parent oxazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • imidoesters
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary carboxylic acid amides
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • azacycle
  • organic 1,3-dipolar compound
  • carboxamide group
  • carboxylic acid derivative
  • imido ester
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • oxazoline
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound