Compound Identification
SMILES
O[C@@H](CCCC(O)=O)[C@H](SC1=CC=C(C=C1)C(O)=O)\C=C/CCCCCCCCCOC1=CC=CC=C1
InChIKey
InChIKey=DHWKLIPYLQPPOH-SIWYVFQGSA-N
Formula
C30H40O6S
Mass
528.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Long-chain fatty acids
-
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
Long-chain fatty acids
Alternative Parents
P-sulfanylbenzoic acids Benzoic acids Thiophenol ethers Phenoxy compounds Phenol ethers Benzoyl derivatives Thia fatty acids Alkyl aryl ethers Hydroxy fatty acids Alkylarylthioethers Unsaturated fatty acids Dicarboxylic acids and derivatives Secondary alcohols Sulfenyl compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Long-chain fatty acid - P-sulfanylbenzoic acid or derivatives - P-sulfanylbenzoic acid - Benzoic acid or derivatives - Benzoic acid - Phenoxy compound - Aryl thioether - Phenol ether - Thiophenol ether - Benzoyl - Alkyl aryl ether - Hydroxy fatty acid - Alkylarylthioether - Thia fatty acid - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Secondary alcohol - Sulfenyl compound - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Carbonyl group - Organic oxygen compound - Alcohol - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms.
External Descriptors
Not available