Compound Identification
SMILES
COC1=C(C)C(OC)=C(C=C1)C1NC(CC2=CNC3=CC=CC=C23)(C2C1C(=O)N(C2=O)C1=CC=C(C=C1)C(C)=O)C(O)=O
InChIKey
InChIKey=YEXBVSYLVJPGGY-UHFFFAOYSA-N
Formula
C33H31N3O7
Mass
581.625
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
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Level 5
Ketones
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Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
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Level 6
Aryl ketones
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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
Phenylpyrrolidines 3-alkylindoles Alpha amino acids Dimethoxybenzenes Acetophenones Pyrrolidine carboxylic acids Phenoxy compounds Anisoles Aryl alkyl ketones Benzoyl derivatives Toluenes Alkyl aryl ethers Aralkylamines N-substituted carboxylic acid imides Substituted pyrroles Pyrrolidine-2-ones Dicarboximides Heteroaromatic compounds Amino acids Lactams Dialkylamines Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 1-phenylpyrrolidine - 2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - M-dimethoxybenzene - Dimethoxybenzene - Acetophenone - Indole - Indole or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Anisole - Methoxybenzene - Aryl alkyl ketone - Aralkylamine - Toluene - Alkyl aryl ether - 2-pyrrolidone - Monocyclic benzene moiety - Benzenoid - Carboxylic acid imide, n-substituted - Pyrrolidone - Substituted pyrrole - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Pyrrole - Pyrrolidine - Amino acid or derivatives - Amino acid - Lactam - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Secondary aliphatic amine - Carboxylic acid - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic 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