Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:04 UTC
Update Date2025-03-21 18:41:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134205
Frequency18.8
Structure
Chemical FormulaC15H22N2O7S
Molecular Mass374.1148
SMILESNS(=O)(=O)OCC(O)C(Cc1ccccc1)NC(=O)OC1CCOC1
InChI KeyRCZGYTLSXCIKBT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • carbamate esters
  • carbonyl compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organic sulfuric acids and derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonyl group
  • ether
  • carbonic acid derivative
  • organic sulfuric acid or derivatives
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • carbamic acid ester
  • dialkyl ether
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • amphetamine or derivatives