Compound Identification
SMILES
CCCCCCCCCC(CCCCCCCCCCCC(O)=O)OC1OC(CO)C(O)C(O)C1OC1OC(COC(O)CC(O)=O)C(O)C(O)C1O
InChIKey
InChIKey=IBTCAQFUEBTWCN-UHFFFAOYSA-N
Formula
C37H68O16
Mass
768.935
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acyl glycosides
- Level 5 Sophorolipids
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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
Very long-chain fatty acids Disaccharides O-glycosyl compounds Beta hydroxy acids and derivatives Heterocyclic fatty acids Hydroxy fatty acids Dicarboxylic acids and derivatives Oxanes Secondary alcohols Hemiacetals Polyols Acetals Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Primary alcohols Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Sophorolipid - Very long-chain fatty acid - Disaccharide - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Heterocyclic fatty acid - Hydroxy fatty acid - Fatty acid - Dicarboxylic acid or derivatives - Hydroxy acid - Oxane - Hemiacetal - Secondary alcohol - Acetal - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Polyol - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Carbonyl group - Primary alcohol - 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