Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:55 UTC
Update Date2025-03-25 00:47:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162230
Frequency0.5
Structure
Chemical FormulaC10H18O3
Molecular Mass186.1256
SMILESC=CC1(C)CCCC(O)(C(C)O)O1
InChI KeyMKFJHFMUCGPSJY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organooxygen compound