Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:43:24 UTC
Update Date2025-03-24 22:20:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01162429
Frequency1.2
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESOC1C2CNCC(O2)C1O
InChI KeyYQXGMMJAVBBDOW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • dialkyl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • monosaccharides
  • morpholines
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • ether
  • monosaccharide
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • saccharide
  • organonitrogen compound
  • organopnictogen compound
  • 1,2-diol
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • tetrahydrofuran
  • secondary amine
  • oxazinane
  • oxacycle
  • morpholine
  • azepane
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine