DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:17:52 UTC
Update Date	2025-03-25 01:00:18 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02242114
Frequency	0.5
Structure
Chemical Formula	C₁₉H₂₈N₄O₅
Molecular Mass	392.206
SMILES	CC(C)CC(N)C(=O)NCCC(=O)NC(CC(=O)c1ccccc1N)C(=O)O
InChI Key	GHYKOVHKLUEEQW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alkyl-phenylketones alpha amino acid amides alpha amino acids amino acids aryl alkyl ketones benzoyl derivatives beta amino acids and derivatives butyrophenones carboxylic acids gamma-keto acids and derivatives hydrocarbon derivatives leucine and derivatives monoalkylamines monocarboxylic acids and derivatives n-acyl amines n-acyl-alpha amino acids organic oxides organopnictogen compounds secondary carboxylic acid amides vinylogous amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group carboxylic acid aryl alkyl ketone amino acid or derivatives amino acid fatty amide benzoyl alpha-amino acid or derivatives carboxylic acid derivative ketone organic oxide leucine or derivatives organonitrogen compound alpha-amino acid organopnictogen compound n-acyl-alpha amino acid or derivatives vinylogous amide alpha-amino acid amide n-acyl-alpha-amino acid carboxamide group n-acyl-amine beta amino acid or derivatives phenylketone gamma-keto acid butyrophenone aromatic homomonocyclic compound secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound keto acid hybrid peptide hydrocarbon derivative benzenoid primary aliphatic amine primary amine organic nitrogen compound amine alkyl-phenylketone organooxygen compound aryl ketone

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