Compound Identification
SMILES
CC(\C=C\CC\C=C\C=C\C=C(/C)C(O)=O)C(O)C(C)C(O)\C=C\C=C\C=C\C=C\C=C\C=C\CCC(OS(O)(=O)=O)C(C)C(=O)CC(O)CC(O)\C=C\CC(O)CC(O)\C=C\CC(O)CC(O)CC(O)\C=C\CC(O)CC(O)CCCN=C(NC(C)=O)NC(C)=O
InChIKey
InChIKey=DUGWPOLJPIWYLF-MNIMVHDTSA-N
Formula
C68H105N3O20S
Mass
1316.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Very long-chain fatty acids
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Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Very long-chain fatty acids
Alternative Parents
Sulfated fatty acids Methyl-branched fatty acids Hydroxy fatty acids Unsaturated fatty acids Sulfuric acid monoesters Alkyl sulfates Beta-hydroxy ketones Acetamides Secondary alcohols Guanidines Propargyl-type 1,3-dipolar organic compounds Polyols Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Very long-chain fatty acid - Sulfated fatty acid - Branched fatty acid - Hydroxy fatty acid - Methyl-branched fatty acid - Beta-hydroxy ketone - Sulfuric acid ester - Alkyl sulfate - Unsaturated fatty acid - Sulfate-ester - Sulfuric acid monoester - Acetamide - Organic sulfuric acid or derivatives - Guanidine - Ketone - Secondary alcohol - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Monocarboxylic acid or derivatives - Polyol - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as very long-chain fatty acids. These are fatty acids with an aliphatic tail that contains at least 22 carbon atoms.
External Descriptors
Not available