DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:09:22 UTC
Update Date	2025-03-25 00:57:09 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02223050
Frequency	0.5
Structure
Chemical Formula	C₁₃H₂₅NO₄
Molecular Mass	259.1784
SMILES	NC(CCCCCCCCC(=O)O)CCC(=O)O
InChI Key	QEYBHBSGZAEKQX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	fatty acyls
Subclass	fatty acids and conjugates
Direct Parent	long-chain fatty acids
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	amino fatty acids carbonyl compounds carboxylic acids dicarboxylic acids and derivatives gamma amino acids and derivatives hydrocarbon derivatives monoalkylamines organic oxides organonitrogen compounds organopnictogen compounds
Substituents	aliphatic acyclic compound carbonyl group long-chain fatty acid carboxylic acid gamma amino acid or derivatives carboxylic acid derivative amino fatty acid organic oxide organic oxygen compound organonitrogen compound dicarboxylic acid or derivatives organopnictogen compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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