Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:55 UTC
Update Date2025-03-25 00:50:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180616
Frequency0.5
Structure
Chemical FormulaC14H16N2O3
Molecular Mass260.1161
SMILESCOc1cc(NC(C)=O)ccc1NCc1ccco1
InChI KeyXGXVUGMHTWFTTF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent acetanilides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • alkyl aryl ethers
  • amino acids and derivatives
  • anisoles
  • carbonyl compounds
  • carboxylic acids and derivatives
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methoxybenzenes
  • n-acetylarylamines
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • phenoxy compounds
  • phenylalkylamines
  • secondary alkylarylamines
  • secondary carboxylic acid amides
  • Substituents
  • furan
  • phenol ether
  • carbonyl group
  • ether
  • n-acetylarylamine
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • n-arylamide
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • acetamide
  • acetanilide
  • heteroaromatic compound
  • secondary amine
  • carboxamide group
  • methoxybenzene
  • secondary aliphatic/aromatic amine
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • anisole
  • phenylalkylamine
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • organooxygen compound