DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:39:58 UTC
Update Date	2025-03-25 00:46:32 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02155770
Frequency	0.5
Structure
Chemical Formula	C₁₁H₂₁N₂O₅+
Molecular Mass	261.1445
SMILES	C[N+](C)(C)C(=O)C(CCC(=O)O)NCCC(=O)O
InChI Key	SDYFFAOVQSGYRF-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 acid amides alpha amino acids amino acids carbonyl compounds carboxylic acids dialkylamines dicarboxylic acids and derivatives fatty acids and conjugates hydrocarbon derivatives organic cations organic oxides organopnictogen compounds
Substituents	aliphatic acyclic compound secondary aliphatic amine carbonyl group carboxylic acid alpha-amino acid amide amino acid fatty acid glutamic acid or derivatives secondary amine organic oxide organic oxygen compound organonitrogen compound alpha-amino acid dicarboxylic acid or derivatives organopnictogen compound hydrocarbon derivative organic nitrogen compound organic cation organooxygen compound amine

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