DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:44:37 UTC
Update Date	2025-03-21 18:00:12 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00025777
Frequency	149.3
Structure
Chemical Formula	C₅H₁₃N₃O
Molecular Mass	131.1059
SMILES	NCC(N)CCC(N)=O
InChI Key	AFMSPXMTJAWSIB-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	delta amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	carbonyl compounds carboxylic acids and derivatives fatty amides gamma amino acids and derivatives hydrocarbon derivatives monoalkylamines organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound carbonyl group gamma amino acid or derivatives fatty amide carboxamide group organic oxide organic oxygen compound organonitrogen compound organopnictogen compound delta amino acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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