DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 09:09:25 UTC
Update Date	2025-03-24 20:11:43 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01369962
Frequency	1.0
Structure
Chemical Formula	C₃₅H₅₈ClNO₂₈
Molecular Mass	975.2834
SMILES	CC(=O)NC1C(O)CC(OCC2OC(OC3C(O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3Cl)C(O)C(O)C2O)(C(=O)O)OC1C(O)C(O)CO
InChI Key	KUHBUPDKQHNTDM-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 of mono- and disaccharides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetamides alkyl chlorides alkyl glycosides alpha-hydroxyaldehydes beta-hydroxy aldehydes c-glucuronides carboxylic acids hydrocarbon derivatives ketals monocarboxylic acids and derivatives monosaccharides organic oxides organochlorides organonitrogen compounds organopnictogen compounds oxacyclic compounds oxanes primary alcohols pyran carboxylic acids secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl glycoside of mono- or disaccharide beta-hydroxy aldehyde carbonyl group carboxylic acid alkyl chloride organochloride monosaccharide carboxylic acid derivative organohalogen compound pyran carboxylic acid saccharide organic oxide alpha-hydroxyaldehyde acetal ketal aliphatic heteromonocyclic compound organonitrogen compound organopnictogen compound alkyl halide oxane primary alcohol organoheterocyclic compound acetamide c-glucuronide alcohol pyran carboxylic acid or derivatives aldehyde carboxamide group oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound pyran secondary alcohol hydrocarbon derivative organic nitrogen compound organooxygen compound alkyl glycoside

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