Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.CCCOCC1=C(OCC(O)CN2CCCC2)C=CC(=C1)C(C)=O.CCCOCC1=C(OCC(O)CN2CCCC2)C=CC(=C1)C(C)=O
InChIKey
InChIKey=LAOCGLYVYUMEOP-WXXKFALUSA-N
Formula
C42H62N2O12
Mass
786.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Acetophenones Benzylethers Aryl alkyl ketones Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Unsaturated fatty acids N-alkylpyrrolidines Dicarboxylic acids and derivatives 1,2-aminoalcohols Secondary alcohols Trialkylamines Carboxylic acids Azacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Alkyl-phenylketone - Acetophenone - Benzylether - Phenoxy compound - Benzoyl - Aryl alkyl ketone - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Fatty acid - Benzenoid - N-alkylpyrrolidine - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Pyrrolidine - 1,2-aminoalcohol - Tertiary amine - Secondary alcohol - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Alcohol - Organic oxide - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available