DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:05:04 UTC
Update Date	2025-03-25 00:55:35 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02213109
Frequency	0.5
Structure
Chemical Formula	C₁₄H₂₃NO₅
Molecular Mass	285.1576
SMILES	CCCCCCC(=C=O)NC(CCCC(=O)O)C(=O)O
InChI Key	NWYINCDKDBGPSK-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	delta amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acids amino acids amino fatty acids carbonyl compounds carboxylic acids dialkylamines dicarboxylic acids and derivatives fatty acyls hydrocarbon derivatives medium-chain fatty acids organic oxides organopnictogen compounds ynolates
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid amino acid alpha-amino acid or derivatives organic oxide organonitrogen compound alpha-amino acid organopnictogen compound delta amino acid or derivatives medium-chain fatty acid secondary aliphatic amine secondary amine amino fatty acid organic oxygen compound ynolate dicarboxylic acid or derivatives hydrocarbon derivative organic nitrogen compound organooxygen compound amine

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