Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:59 UTC
Update Date2025-03-25 00:49:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171556
Frequency0.5
Structure
Chemical FormulaC8H9N3O
Molecular Mass163.0746
SMILESCN1C(=O)CC1c1cncnc1
InChI KeyGVILVUKBNBWPDR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass beta lactams
Direct Parent monobactams
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrimidines and pyrimidine derivatives
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • monobactam
  • carboxamide group
  • carboxylic acid derivative
  • pyrimidine
  • azetidine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound