DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:57:58 UTC
Update Date	2025-03-21 18:05:31 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00057334
Frequency	55.3
Structure
Chemical Formula	C₁₄H₂₇NO₄
Molecular Mass	273.194
SMILES	NC(CO)C(=O)CCCCCCCCCCC(=O)O
InChI Key	CCXKXRMFIIORMI-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 beta-hydroxy ketones carboxylic acids hydrocarbon derivatives hydroxy fatty acids monoalkylamines monocarboxylic acids and derivatives organic oxides organonitrogen compounds organopnictogen compounds primary alcohols
Substituents	alcohol beta-hydroxy ketone aliphatic acyclic compound carbonyl group long-chain fatty acid carboxylic acid carboxylic acid derivative amino fatty acid ketone organic oxide monocarboxylic acid or derivatives organic oxygen compound organonitrogen compound organopnictogen compound hydrocarbon derivative hydroxy fatty acid primary aliphatic amine organic nitrogen compound primary alcohol organooxygen compound

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