DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:46:16 UTC
Update Date	2025-03-25 00:48:44 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02169912
Frequency	0.5
Structure
Chemical Formula	C₁₄H₂₅N₅O₅
Molecular Mass	343.1856
SMILES	CCOC(=O)N1CCCC1C(=O)NC(CCCNC(=N)N)C(=O)O
InChI Key	RPHNEAKXJTYILO-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	dipeptides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids arginine and derivatives azacyclic compounds carbamate esters carbonyl compounds carboximidamides carboxylic acids guanidines heterocyclic fatty acids hydrocarbon derivatives imines monocarboxylic acids and derivatives n-acyl-alpha amino acids organic carbonic acids and derivatives organic oxides organopnictogen compounds proline and derivatives pyrrolidine carboxylic acids pyrrolidinecarboxamides secondary carboxylic acid amides short-chain hydroxy acids and derivatives
Substituents	fatty acyl carbonyl group carboxylic acid short-chain hydroxy acid heterocyclic fatty acid guanidine imine fatty acid alpha-amino acid or derivatives organic oxide arginine or derivatives pyrrolidine carboxylic acid aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound pyrrolidine organoheterocyclic compound n-acyl-alpha amino acid or derivatives proline or derivatives carbonic acid derivative alpha-amino acid amide azacycle n-acyl-alpha-amino acid carbamic acid ester carboximidamide carboxamide group alpha-dipeptide secondary carboxylic acid amide monocarboxylic acid or derivatives pyrrolidine carboxylic acid or derivatives organic oxygen compound hydrocarbon derivative organic nitrogen compound pyrrolidine-2-carboxamide organooxygen compound

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