Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:55 UTC
Update Date2025-03-25 00:56:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02217331
Frequency0.5
Structure
Chemical FormulaC11H17NO3
Molecular Mass211.1208
SMILESC=CC1(O)CN(C(=O)OC)C2CCCC21
InChI KeyYNZCQBOVJXTCBB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidine carboxylic acids and derivatives
Direct Parent pyrrolidine carboxylic acids
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • hydrocarbon derivatives
  • methylcarbamates
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • methylcarbamate
  • carbamic acid ester
  • aliphatic heteropolycyclic compound
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound