DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:40:16 UTC
Update Date	2025-03-25 00:46:38 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02156392
Frequency	0.5
Structure
Chemical Formula	C₁₄H₃₂N₂O₃+₂
Molecular Mass	276.2402
SMILES	C[N+](C)(C)CCOC(CCCC(=O)O)C[N+](C)(C)C
InChI Key	WZAKBLNWDJJZJK-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	hydroxy acids and derivatives
Subclass	medium-chain hydroxy acids and derivatives
Direct Parent	medium-chain hydroxy acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	amines amino fatty acids carbonyl compounds carboxylic acids dialkyl ethers hydrocarbon derivatives medium-chain fatty acids monocarboxylic acids and derivatives organic cations organic oxides organic salts organopnictogen compounds tetraalkylammonium salts
Substituents	fatty acyl aliphatic acyclic compound carbonyl group ether carboxylic acid fatty acid carboxylic acid derivative medium-chain hydroxy acid dialkyl ether organic oxide organonitrogen compound organopnictogen compound medium-chain fatty acid organic cation organic salt tetraalkylammonium salt quaternary ammonium salt amino fatty acid monocarboxylic acid or derivatives organic oxygen compound hydrocarbon derivative organic nitrogen compound amine organooxygen compound

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