Hmdb loader

Showing information for DMID00107647

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:53 UTC
Update Date2025-03-21 18:35:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107647
Frequency25.0
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESCN1C2CC(O)C1C1OC12
InChI KeyFSECMNNUCDOKMQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • morpholines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • trialkylamines
    • Substituents
  • ether
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • tertiary amine
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • oxirane
  • cyclic alcohol
  • oxazinane
  • oxepane
  • oxacycle
  • morpholine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound