DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:49:06 UTC
Update Date	2025-03-21 18:02:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00036412
Frequency	208.7
Structure
Chemical Formula	C₇H₁₆N₄O
Molecular Mass	172.1324
SMILES	CN(C)C(N)=NCCCC(N)=O
InChI Key	SCOOUCHKAWPRKW-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	gamma amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	carbonyl compounds carboximidamides carboxylic acids and derivatives fatty amides guanidines hydrocarbon derivatives organic oxides organopnictogen compounds primary carboxylic acid amides propargyl-type 1,3-dipolar organic compounds
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound carbonyl group gamma amino acid or derivatives guanidine fatty amide organic 1,3-dipolar compound carboximidamide carboxamide group propargyl-type 1,3-dipolar organic compound organic oxide organic oxygen compound organonitrogen compound organopnictogen compound hydrocarbon derivative organic nitrogen compound organooxygen compound

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