DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:13:25 UTC
Update Date	2025-03-21 18:33:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00094212
Frequency	29.5
Structure
Chemical Formula	C₁₄H₂₂N₂O₂
Molecular Mass	250.1681
SMILES	CCOc1ccc(NC(=O)CN(CC)CC)cc1
InChI Key	FCIFJJOPLXDBHS-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	alpha amino acid amides
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alkyl aryl ethers alpha amino acids anilides carbonyl compounds carboxylic acids and derivatives hydrocarbon derivatives n-arylamides organic oxides organopnictogen compounds phenol ethers phenoxy compounds secondary carboxylic acid amides trialkylamines
Substituents	phenol ether monocyclic benzene moiety carbonyl group ether n-arylamide alkyl aryl ether organic oxide organonitrogen compound alpha-amino acid organopnictogen compound tertiary amine alpha-amino acid amide tertiary aliphatic amine carboxamide group aromatic homomonocyclic compound anilide secondary carboxylic acid amide organic oxygen compound hydrocarbon derivative benzenoid organic nitrogen compound phenoxy compound amine organooxygen compound

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