Structure Information
Structure

Compound Identification

SMILES

CC1CCCCCC\C=C/CCCCCCCC(=O)O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]3O1)[C@H](O)[C@H]2O.CC(CCCCCC\C=C/CCCCCCCC(O)=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

InChIKey

InChIKey=ICIPDLXOTNOSRG-PECFFGBBSA-N

Formula

C60H106O25

Mass

1227.483

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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

Not available

Substituents

Sophorolipid - Saccharolipid - Long-chain fatty acid - Macrolide - Disaccharide - Glycosyl compound - O-glycosyl compound - Heterocyclic fatty acid - Hydroxy fatty acid - Unsaturated fatty acid - Fatty acid - Oxane - Carboxylic acid ester - Secondary alcohol - Lactone - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Acetal - Carboxylic acid - Oxacycle - Carboxylic acid derivative - Polyol - Organic oxide - Organic oxygen compound - Primary alcohol - Hydrocarbon derivative - Alcohol - Carbonyl group - Organooxygen compound - Aliphatic heteropolycyclic 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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