DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:08:23 UTC
Update Date	2025-03-25 00:56:47 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02220750
Frequency	0.5
Structure
Chemical Formula	C₁₁H₁₇NO₈
Molecular Mass	291.0954
SMILES	O=C(O)CCCNC(=O)CC(O)(CC(=O)O)CC(=O)O
InChI Key	MGNHUCQSDAAVHT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	gamma amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	carbonyl compounds carboxylic acids hydrocarbon derivatives n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds secondary carboxylic acid amides tertiary alcohols tricarboxylic acids and derivatives
Substituents	alcohol fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid gamma amino acid or derivatives fatty amide tricarboxylic acid or derivatives carboxamide group n-acyl-amine secondary carboxylic acid amide tertiary alcohol organic oxide organic oxygen compound organonitrogen compound organopnictogen compound hydrocarbon derivative organic nitrogen compound organooxygen compound

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