Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:13 UTC
Update Date2025-03-21 18:32:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00091307
Frequency30.7
Structure
Chemical FormulaC9H18O2
Molecular Mass158.1307
SMILESCC1CCC(O)(C(C)C)OC1
InChI KeyNKMMNYORVVYJSK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organooxygen compound