Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:01:34 UTC
Update Date2025-03-24 16:37:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00918019
Frequency1.6
Structure
Chemical FormulaC6H10N2O2
Molecular Mass142.0742
SMILESO=C(O)CC1CCN=CN1
InChI KeySKFLNGZOYYKTPL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydropyrimidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • formamidines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • 1,4,5,6-tetrahydropyrimidine
  • carbonyl group
  • carboxylic acid
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hydropyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound