Hmdb loader

Showing information for DMID02087352

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:10:34 UTC
Update Date2025-03-25 00:36:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02087352
Frequency0.6
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCN1CC(C)(C)CC1=C=O
InChI KeyPRLJUJHBDFRGET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • ynolates
    • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • ynolate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound