DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:16:45 UTC
Update Date	2025-03-25 00:59:50 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02239522
Frequency	0.5
Structure
Chemical Formula	C₇H₁₆N₆O₃
Molecular Mass	232.1284
SMILES	N=C(NCCCC(N)C(=O)O)NC(N)N=O
InChI Key	OYVRHIUBICYZIF-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	arginine and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acids c-nitroso compounds carbonyl compounds carboximidamides carboxylic acids fatty acids and conjugates guanidines hydrocarbon derivatives imines monoalkylamines monocarboxylic acids and derivatives organic oxides organopnictogen compounds ortho amides orthocarboxylic acid derivatives propargyl-type 1,3-dipolar organic compounds
Substituents	aliphatic acyclic compound carbonyl group carboxylic acid ortho amide guanidine imine fatty acid propargyl-type 1,3-dipolar organic compound organic oxide arginine or derivatives organonitrogen compound alpha-amino acid organopnictogen compound orthocarboxylic acid derivative organic nitroso compound organic 1,3-dipolar compound carboximidamide monocarboxylic acid or derivatives organic oxygen compound c-nitroso compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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