DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:09:24 UTC
Update Date	2025-03-25 00:57:10 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02223096
Frequency	0.5
Structure
Chemical Formula	C₁₉H₂₀N₂O₄
Molecular Mass	340.1423
SMILES	NC(CCC(=O)OC1Oc2ccccc2NC1=O)Cc1ccccc1
InChI Key	YEFIJKDPHKHNHV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	gamma amino acids and derivatives
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	acetals amphetamines and derivatives azacyclic compounds benzene and substituted derivatives benzomorpholines benzoxazinones carbonyl compounds carboxylic acid esters fatty acid esters hydrocarbon derivatives lactams monoalkylamines monocarboxylic acids and derivatives organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group lactam gamma amino acid or derivatives benzomorpholine organic oxide acetal aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound organoheterocyclic compound amphetamine or derivatives azacycle benzoxazine carboxamide group oxazinane oxacycle secondary carboxylic acid amide fatty acid ester morpholine monocarboxylic acid or derivatives benzoxazinone organic oxygen compound carboxylic acid ester hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

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