DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 13:00:26 UTC
Update Date	2025-03-24 21:52:54 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01920475
Frequency	0.6
Structure
Chemical Formula	C₃₃H₅₅N₃O₂₄
Molecular Mass	877.3176
SMILES	CC(=O)NC1C(O)CC(OCC2OC(OC(C(O)CO)C(O)C(O)C=O)C(O)C(OC3C(NC(C)=O)C(O)OC(CO)C3NC(C)=O)C2O)(C(=O)O)OC1C(O)C(O)CO
InChI Key	SEAXQVKGNGBLHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic oxygen compounds
Class	organooxygen compounds
Subclass	carbohydrates and carbohydrate conjugates
Direct Parent	acylaminosugars
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetamides alkyl glycosides alpha-hydroxyaldehydes aminosaccharides beta-hydroxy aldehydes c-glucuronides carboxylic acids dialkyl ethers fatty acyl glycosides of mono- and disaccharides hemiacetals hydrocarbon derivatives ketals monocarboxylic acids and derivatives monosaccharides organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes primary alcohols pyran carboxylic acids secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl fatty acyl glycoside of mono- or disaccharide beta-hydroxy aldehyde carbonyl group ether carboxylic acid monosaccharide carboxylic acid derivative pyran carboxylic acid dialkyl ether organic oxide alpha-hydroxyaldehyde acetal ketal aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound hemiacetal oxane primary alcohol organoheterocyclic compound acetamide c-glucuronide alcohol pyran carboxylic acid or derivatives fatty acyl glycoside aldehyde carboxamide group oxacycle secondary carboxylic acid amide acylaminosugar monocarboxylic acid or derivatives pyran secondary alcohol hydrocarbon derivative organic nitrogen compound alkyl glycoside

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