DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:40:01 UTC
Update Date	2025-03-25 00:46:33 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02155882
Frequency	0.5
Structure
Chemical Formula	C₁₁H₂₇N₄O+
Molecular Mass	231.2179
SMILES	C[N+](C)(C)CCNC(=O)C(N)CCCCN
InChI Key	NNLKTUQWHGUCLS-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	alpha amino acid amides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acids amines carbonyl compounds carboxylic acids and derivatives hydrocarbon derivatives monoalkylamines n-acyl amines organic cations organic oxides organic salts organopnictogen compounds secondary carboxylic acid amides tetraalkylammonium salts
Substituents	fatty acyl aliphatic acyclic compound carbonyl group fatty amide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound organic cation organic salt alpha-amino acid amide tetraalkylammonium salt quaternary ammonium salt carboxamide group n-acyl-amine secondary carboxylic acid amide organic oxygen compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound amine organooxygen compound

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