DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:57:59 UTC
Update Date	2025-03-25 00:52:53 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02196591
Frequency	0.5
Structure
Chemical Formula	C₁₁H₂₄NO₃+
Molecular Mass	218.1751
SMILES	CCC(C[N+](C)(C)C)OCCCC(=O)O
InChI Key	OARMLRCONHFGRS-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	hydroxy acids and derivatives
Subclass	short-chain hydroxy acids and derivatives
Direct Parent	short-chain hydroxy acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	amines carbonyl compounds carboxylic acids dialkyl ethers fatty acids and conjugates hydrocarbon derivatives monocarboxylic acids and derivatives organic cations organic oxides organic salts organopnictogen compounds tetraalkylammonium salts
Substituents	aliphatic acyclic compound carbonyl group ether carboxylic acid short-chain hydroxy acid tetraalkylammonium salt quaternary ammonium salt fatty acid carboxylic acid derivative dialkyl ether organic oxide monocarboxylic acid or derivatives organic oxygen compound organonitrogen compound organopnictogen compound hydrocarbon derivative organic nitrogen compound organic cation organic salt amine organooxygen compound

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