DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:43:29 UTC
Update Date	2025-03-25 00:47:43 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02163535
Frequency	0.5
Structure
Chemical Formula	C₁₄H₂₄N₂O₁₁
Molecular Mass	396.138
SMILES	CC(=O)NC1C(OC(C(O)C=O)C(O)C(N)C(=O)O)OC(CO)C(O)C1O
InChI Key	WWOKVGPCLFEPHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	saccharolipids
Subclass	saccharolipids
Direct Parent	saccharolipids
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetals acetamides alpha amino acids alpha-hydroxyaldehydes amino fatty acids beta hydroxy acids and derivatives carboxylic acids heterocyclic fatty acids hydrocarbon derivatives hydroxy fatty acids medium-chain fatty acids medium-chain hydroxy acids and derivatives monoalkylamines monocarboxylic acids and derivatives monosaccharides n-acyl-alpha-hexosamines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes primary alcohols secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl carbonyl group carboxylic acid heterocyclic fatty acid monosaccharide fatty acid alpha-amino acid or derivatives carboxylic acid derivative medium-chain hydroxy acid n-acyl-alpha-hexosamine beta-hydroxy acid saccharide organic oxide alpha-hydroxyaldehyde acetal aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound medium-chain fatty acid hydroxy fatty acid oxane primary alcohol organoheterocyclic compound acetamide alcohol aldehyde hydroxy acid carboxamide group amino fatty acid oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound secondary alcohol hydrocarbon derivative primary aliphatic amine organic nitrogen compound saccharolipid organooxygen compound

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