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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
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Subclass
Fatty acyl glycosides
- Level 5 Sophorolipids
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Subclass
Fatty acyl glycosides
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Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
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
Saccharolipids Long-chain fatty acids Macrolides and analogues Disaccharides O-glycosyl compounds Heterocyclic fatty acids Hydroxy fatty acids Unsaturated fatty acids Oxanes Secondary alcohols Lactones Carboxylic acid esters Polyols Monocarboxylic acids and derivatives Acetals Carboxylic acids Oxacyclic compounds Organic oxides Primary alcohols Carbonyl compounds Hydrocarbon derivatives
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