DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:21:17 UTC
Update Date	2025-03-25 01:01:32 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02250050
Frequency	0.5
Structure
Chemical Formula	C₁₀H₂₁N₂O₅+
Molecular Mass	249.1445
SMILES	C[N+](C)(C)CCOC(CC(N)C(=O)O)C(=O)O
InChI Key	UTXDJVWOCIQLAG-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	glutamic acid and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acids amines carbonyl compounds carboxylic acids dialkyl ethers dicarboxylic acids and derivatives fatty acids and conjugates hydrocarbon derivatives monoalkylamines organic cations organic oxides organic salts organopnictogen compounds short-chain hydroxy acids and derivatives tetraalkylammonium salts
Substituents	aliphatic acyclic compound carbonyl group ether carboxylic acid short-chain hydroxy acid fatty acid dialkyl ether organic oxide organonitrogen compound alpha-amino acid organopnictogen compound organic cation organic salt tetraalkylammonium salt quaternary ammonium salt glutamic acid or derivatives organic oxygen compound dicarboxylic acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound amine organooxygen compound

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