DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:58:38 UTC
Update Date	2025-03-25 00:53:08 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02198076
Frequency	0.5
Structure
Chemical Formula	C₁₅H₂₉NO₃
Molecular Mass	271.2147
SMILES	CCCCCCCCC=CC(O)C(N)CCC(=O)O
InChI Key	LCXHEFSFKWWLCZ-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 fatty acyls gamma amino acids and derivatives hydrocarbon derivatives hydroxy fatty acids monoalkylamines monocarboxylic acids and derivatives organic oxides organonitrogen compounds organopnictogen compounds secondary alcohols
Substituents	alcohol aliphatic acyclic compound carbonyl group long-chain fatty acid carboxylic acid gamma amino acid or derivatives carboxylic acid derivative amino fatty acid organic oxide monocarboxylic acid or derivatives organic oxygen compound organonitrogen compound secondary alcohol organopnictogen compound hydrocarbon derivative hydroxy fatty acid primary aliphatic amine organic nitrogen compound organooxygen compound

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