Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:14 UTC
Update Date2025-03-25 01:00:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240645
Frequency0.5
Structure
Chemical FormulaC20H32N2O4
Molecular Mass364.2362
SMILESCC(C)(C)CNCC(O)C(Cc1ccccc1)NC(=O)OC1CCOC1
InChI KeyHWZWOYXLTTWAFM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylbutylamines
Direct Parent phenylbutylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • amphetamines and derivatives
  • carbamate esters
  • carbonyl compounds
  • dialkyl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • ether
  • aromatic heteromonocyclic compound
  • dialkyl ether
  • organic oxide
  • phenylbutylamine
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • amphetamine or derivatives
  • alcohol
  • secondary aliphatic amine
  • carbonic acid derivative
  • tetrahydrofuran
  • carbamic acid ester
  • secondary amine
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine