Compound Identification
SMILES
CCCCCCCCCCCCCCCC(O)=O.COC(=O)[C@H](N1CCC2=C(C1)C=CS2)C1=CC=CC=C1Cl
InChIKey
InChIKey=CXRMWOGQHRFLPW-XFULWGLBSA-N
Formula
C32H48ClNO4S
Mass
578.25
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
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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
Alpha amino acid esters Thienopyridines Aralkylamines Chlorobenzenes Straight chain fatty acids Pyridines and derivatives Aryl chlorides Thiophenes Heteroaromatic compounds Methyl esters Trialkylamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Not available
Substituents
Long-chain fatty acid - Alpha-amino acid ester - Alpha-amino acid or derivatives - Thienopyridine - Halobenzene - Aralkylamine - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Straight chain fatty acid - Heteroaromatic compound - Methyl ester - Thiophene - Carboxylic acid ester - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organooxygen compound - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - 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