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