DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:17:35 UTC
Update Date	2025-03-25 01:00:10 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02241433
Frequency	0.5
Structure
Chemical Formula	C₁₃H₂₄N₆O₆
Molecular Mass	360.1757
SMILES	CC(NC(=O)CC(NC(=O)C(N)CCCNC(=N)N)C(=O)O)C(=O)O
InChI Key	UQULENJITFLPEW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alanine and derivatives alpha amino acid amides alpha amino acids arginine and derivatives asparagine and derivatives carbonyl compounds carboximidamides carboxylic acids dicarboxylic acids and derivatives dipeptides fatty acids and conjugates guanidines hydrocarbon derivatives imines monoalkylamines n-acyl amines n-acyl-alpha amino acids organic oxides organopnictogen compounds secondary carboxylic acid amides
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid guanidine imine fatty amide fatty acid alpha-amino acid or derivatives carboxylic acid derivative organic oxide arginine or derivatives organonitrogen compound alpha-amino acid organopnictogen compound asparagine or derivatives n-acyl-alpha amino acid or derivatives alpha-amino acid amide n-acyl-alpha-amino acid carboximidamide carboxamide group n-acyl-amine alpha-dipeptide secondary carboxylic acid amide organic oxygen compound dicarboxylic acid or derivatives hybrid peptide alanine or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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