Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:54:31 UTC
Update Date2025-03-24 21:23:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01764730
Frequency0.7
Structure
Chemical FormulaC8H11NO
Molecular Mass137.0841
SMILESC=CC1C(=O)N2CCCC12
InChI KeyBQKSEBNGFLIDNC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass beta lactams
Direct Parent carbapenams
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • azepanes
  • azetidines
  • caprolactams
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • tertiary carboxylic acid amides
  • Substituents
  • caprolactam
  • carbonyl group
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • azetidine
  • aliphatic heteropolycyclic compound
  • organic oxide
  • azepane
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • carbapenam
  • organooxygen compound