Compound Identification
SMILES
COC1=C(N)C=CC(=C1)C(=O)C1=NC(NC(=O)C2=CC(OCCCCCCCCOC3=CC=CC(=C3)C(=O)NC3=C4C=C(C=CN4C(=N3)C(=O)C3=CC(OC)=C(N)C=C3)C(O)=O)=CC=C2)=C2C=C(C=CN12)C(O)=O
InChIKey
InChIKey=NNBXGTBFSDBTHD-UHFFFAOYSA-N
Formula
C54H50N8O12
Mass
1003.038
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 Aryl-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
Aryl-phenylketones
Alternative Parents
Aminophenyl ethers Benzamides Imidazopyridines Methoxyanilines Pyridinecarboxylic acids Methoxybenzenes Anisoles Benzoyl derivatives Phenoxy compounds Alkyl aryl ethers N-substituted imidazoles Imidolactams Heteroaromatic compounds Amino acids Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - Benzamide - Benzoic acid or derivatives - Aminophenyl ether - Imidazopyridine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Benzenoid - Pyridine - Imidolactam - N-substituted imidazole - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Imidazole - Secondary carboxylic acid amide - Amino acid - Amino acid or derivatives - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Amine - Primary amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available