DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:17:07 UTC
Update Date	2025-03-25 00:59:58 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02240364
Frequency	0.5
Structure
Chemical Formula	C₂₄H₂₆N₄O₆
Molecular Mass	466.1852
SMILES	NC(Cc1c[nH]c2ccccc12)C(=O)NC(CC(=O)NC(Cc1ccccc1)C(=O)O)C(=O)O
InChI Key	JHQIBAIMZNPNBL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids amphetamines and derivatives asparagine and derivatives azacyclic compounds benzene and substituted derivatives carbonyl compounds carboxylic acids dicarboxylic acids and derivatives dipeptides heteroaromatic compounds hydrocarbon derivatives indoles monoalkylamines n-acyl amines n-acyl-alpha amino acids organic oxides organonitrogen compounds organopnictogen compounds phenylalanine and derivatives phenylpropanoic acids pyrroles secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group carboxylic acid 3-phenylpropanoic-acid indole fatty amide alpha-amino acid or derivatives carboxylic acid derivative organic oxide aromatic heteropolycyclic compound organonitrogen compound alpha-amino acid organopnictogen compound asparagine or derivatives organoheterocyclic compound amphetamine or derivatives n-acyl-alpha amino acid or derivatives alpha-amino acid amide azacycle n-acyl-alpha-amino acid heteroaromatic compound indole or derivatives carboxamide group n-acyl-amine alpha-dipeptide secondary carboxylic acid amide phenylalanine or derivatives organic oxygen compound pyrrole dicarboxylic acid or derivatives hybrid peptide hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

Showing information for DMID02240364