Compound Identification
SMILES
CCCCCCCCCC\C=C/C=C/[C@@H](SC1=CC2=C(C=C1)C(=O)C=C(O2)C(O)=O)[C@@H](O)CCCC(O)=O
InChIKey
InChIKey=KELACENYYCZTBW-YSXRCOGKSA-N
Formula
C30H40O7S
Mass
544.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
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Subclass
Fatty acids and conjugates
- Level 5 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
Long-chain fatty acids
Alternative Parents
Chromones Thiophenol ethers Thia fatty acids Alkylarylthioethers Pyranones and derivatives Heterocyclic fatty acids Hydroxy fatty acids Unsaturated fatty acids Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Sulfenyl compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Long-chain fatty acid - Chromone - Benzopyran - 1-benzopyran - Aryl thioether - Thiophenol ether - Heterocyclic fatty acid - Hydroxy fatty acid - Pyranone - Alkylarylthioether - Thia fatty acid - Pyran - Benzenoid - Unsaturated fatty acid - Heteroaromatic compound - Secondary alcohol - Sulfenyl compound - Thioether - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxide - Alcohol - Aromatic heteropolycyclic 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