DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:10:00 UTC
Update Date	2025-03-21 18:31:30 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00086138
Frequency	42.7
Structure
Chemical Formula	C₁₁H₂₂N₂O₅
Molecular Mass	262.1529
SMILES	CC(C)CC(N)C(=O)NC1OC(CO)C(O)C1O
InChI Key	JMHXQXLNPKXIIO-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	leucine and derivatives
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids carbonyl compounds carboxylic acids and derivatives hydrocarbon derivatives monoalkylamines monosaccharides n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds primary alcohols secondary alcohols secondary carboxylic acid amides tetrahydrofurans
Substituents	fatty acyl carbonyl group fatty amide monosaccharide saccharide organic oxide leucine or derivatives aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound primary alcohol organoheterocyclic compound alcohol alpha-amino acid amide tetrahydrofuran carboxamide group n-acyl-amine oxacycle secondary carboxylic acid amide organic oxygen compound secondary alcohol hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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