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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:17 UTC
Update Date2025-03-25 00:46:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154164
Frequency0.5
Structure
Chemical FormulaC17H24N2O7
Molecular Mass368.1584
SMILESCC(=O)N1CCN(c2ccc(OC3OC(O)C(O)C(O)C3O)cc2)CC1
InChI KeySEYFAPPFDPVCMI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent phenylpiperazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • acetamides
  • amino acids and derivatives
  • aniline and substituted anilines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylarylamines
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • n-arylpiperazines
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • secondary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • acetal
  • tertiary aliphatic/aromatic amine
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • dialkylarylamine
  • tertiary amine
  • acetamide
  • alcohol
  • azacycle
  • aniline or substituted anilines
  • carboxamide group
  • phenylpiperazine
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • n-arylpiperazine
  • organooxygen compound