DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:17:36 UTC
Update Date	2025-03-25 01:00:11 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02241502
Frequency	0.5
Structure
Chemical Formula	C₁₉H₂₉N₅O₈
Molecular Mass	455.2016
SMILES	CC(O)C(=O)N1CCCC1C(=O)NCC(=O)N1CCCC1C(=O)NC(CC(N)=O)C(=O)O
InChI Key	XAZYBKHNUFZERT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids asparagine and derivatives azacyclic compounds carbonyl compounds carboxylic acids fatty amides heterocyclic fatty acids hydrocarbon derivatives hydroxy fatty acids monocarboxylic acids and derivatives n-acyl-alpha amino acids n-acylpyrrolidines organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides proline and derivatives pyrrolidinecarboxamides secondary alcohols secondary carboxylic acid amides short-chain hydroxy acids and derivatives tertiary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl carbonyl group carboxylic acid short-chain hydroxy acid heterocyclic fatty acid fatty amide n-acylpyrrolidine fatty acid alpha-amino acid or derivatives carboxylic acid derivative organic oxide tertiary carboxylic acid amide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound hydroxy fatty acid asparagine or derivatives pyrrolidine organoheterocyclic compound n-acyl-alpha amino acid or derivatives proline or derivatives alcohol alpha-amino acid amide azacycle n-acyl-alpha-amino acid carboxamide group secondary carboxylic acid amide monocarboxylic acid or derivatives pyrrolidine carboxylic acid or derivatives organic oxygen compound secondary alcohol hybrid peptide hydrocarbon derivative organic nitrogen compound pyrrolidine-2-carboxamide organooxygen compound

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