Structure Information
Structure

Compound Identification

SMILES

CCCC[C@@H](CCCCCCCC[C@@H](O)CC(O)=O)O[C@@H]1OC(CO[C@H]2OC(C)[C@@H](O)C(O)C2O)[C@@H](O)C(O)C1O[C@@H]1OC(CO)[C@@H](O)C(O)C1O[C@@H]1OC(C)[C@H](O)C(O)C1O

InChIKey

InChIKey=JWKIOWGQARSDFT-VTJXKHPISA-N

Formula

C40H72O22

Mass

904.994

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acyl glycosides

Intermediate Tree Nodes

Not available

Direct Parent

Sophorolipids

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Sophorolipid - Oligosaccharide - Long-chain fatty acid - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Heterocyclic fatty acid - Hydroxy fatty acid - Hydroxy acid - Fatty acid - Oxane - Secondary alcohol - Polyol - Monocarboxylic acid or derivatives - Acetal - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Primary alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Alcohol - Organooxygen compound - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as sophorolipids. These are glycolipids containing a sophorose moiety linked glycosidically to the hydroxyl group of a 17-hydroxy-C18 saturated fatty acid. The carboxyl group of the fatty acid can be linked to the 4'-hydroxyl of the second glucose to form a lactone.

External Descriptors

Not available

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