Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:02 UTC
Update Date2025-03-25 00:58:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231068
Frequency0.5
Structure
Chemical FormulaC10H17NO4
Molecular Mass215.1158
SMILESCCOC(=O)N1CCCC(C(=O)O)CC1
InChI KeyWPKRSUVCZBIZLQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbamate esters
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carbonic acid derivative
  • carboxylic acid
  • azacycle
  • carbamic acid ester
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • azepane
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound