Compound Identification
SMILES
CCCCC\C=C/C\C=C/C\C=C/CCCCC(O)=O.CN(C)C[C@@H]1CCN2C=C(C3=CC=CC=C23)C2=C(C(=O)NC2=O)C2=CN(CCO1)C1=CC=CC=C21
InChIKey
InChIKey=MHKNMUXKXFRDDK-AQGMUDGBSA-N
Formula
C46H58N4O5
Mass
746.993
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Fatty Acyls
- Subclass Lineolic acids and derivatives
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Class
Fatty Acyls
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Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Lineolic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Lineolic acids and derivatives
Alternative Parents
Long-chain fatty acids Macrolactams Indoles Maleimides Unsaturated fatty acids Straight chain fatty acids Benzenoids Pyrrolines Pyrroles N-unsubstituted carboxylic acid imides Dicarboximides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Dialkyl ethers Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Octadecanoid - Long-chain fatty acid - Macrolactam - Indole - Indole or derivatives - Maleimide - Straight chain fatty acid - Unsaturated fatty acid - Benzenoid - Fatty acid - Carboxylic acid imide - Carboxylic acid imide, n-unsubstituted - Pyrrole - Dicarboximide - Pyrroline - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lineolic acids and derivatives. These are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions.
External Descriptors
Not available