DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:07:58 UTC
Update Date	2025-03-25 00:56:38 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02219775
Frequency	0.5
Structure
Chemical Formula	C₉H₁₇N₂O₃+
Molecular Mass	201.1234
SMILES	C[N+](C)(C)CCN1C(=O)CC(O)C1=O
InChI Key	WRPMXGNDNJKPPZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	carboxylic acid derivatives
Direct Parent	n-substituted carboxylic acid imides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	amines azacyclic compounds carbonyl compounds carboxylic acids and derivatives dicarboximides hydrocarbon derivatives n-alkylpyrrolidines organic cations organic oxides organic salts organopnictogen compounds pyrrolidine-2-ones secondary alcohols tetraalkylammonium salts
Substituents	2-pyrrolidone carbonyl group organic oxide aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound dicarboximide organic cation organic salt pyrrolidine carboxylic acid imide, n-substituted pyrrolidone organoheterocyclic compound alcohol tetraalkylammonium salt azacycle n-alkylpyrrolidine quaternary ammonium salt organic oxygen compound secondary alcohol hydrocarbon derivative organic nitrogen compound amine organooxygen compound

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