Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:34:49 UTC
Update Date2025-03-25 00:20:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01287343
Frequency1.0
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC1CCCOC(=O)O1
InChI KeyJKNNDGRRIOGKKO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxepanes
Subclass 1,3-dioxepanes
Direct Parent 1,3-dioxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonic acid diesters
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • 1,3-dioxepane
  • carbonyl group
  • carbonic acid derivative
  • carbonic acid diester
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound