Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:57:08 UTC
Update Date2025-03-24 20:06:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01340588
Frequency1.0
Structure
Chemical FormulaC5H7N3O2
Molecular Mass141.0538
SMILESNC1=NCCC(C(=O)O)=N1
InChI KeyDLXQVRMTXPSBGK-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
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • 5,6-dihydropyrimidine
  • organic 1,3-dipolar compound
  • carboximidamide
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hydropyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound