DeepMet

Record Information
HMDB Status	quantified
Creation Date	2024-02-21 00:19:43 UTC
Update Date	2025-03-21 18:36:15 UTC
HMDB ID	HMDB0000489
Metabolite Identification
DeepMet ID	DMID00109679
Name	Aspartylglycosamine
Frequency	24.4
Structure
Chemical Formula	C₁₂H₂₁N₃O₈
Molecular Mass	335.1329
SMILES	CC(O)=NC1C(NC(=O)CC(N)C(=O)O)OC(CO)C(O)C1O
InChI Key	YTTRPBWEMMPYSW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lipids and lipid-like molecules
Class	fatty acyls
Subclass	fatty acyl glycosides
Direct Parent	fatty acyl glycosides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acids asparagine and derivatives carbonyl compounds carboximidic acids carboxylic acids heterocyclic fatty acids hydrocarbon derivatives hydroxy fatty acids monoalkylamines monocarboxylic acids and derivatives monosaccharides n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes primary alcohols propargyl-type 1,3-dipolar organic compounds secondary alcohols secondary carboxylic acid amides short-chain hydroxy acids and derivatives
Substituents	carboximidic acid carbonyl group carboxylic acid short-chain hydroxy acid heterocyclic fatty acid fatty amide monosaccharide fatty acid alpha-amino acid or derivatives carboxylic acid derivative propargyl-type 1,3-dipolar organic compound saccharide organic oxide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound hydroxy fatty acid asparagine or derivatives oxane primary alcohol organoheterocyclic compound alcohol organic 1,3-dipolar compound fatty n-acyl glycoside carboxamide group n-acyl-amine oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound secondary alcohol hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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