Compound Identification
SMILES
OC(C(C(C(C(CC(=O)C1=CC=C(Cl)C=C1)C1=CC=NC=C1)C(=O)C1=CC=C(Cl)C=C1)C1=CC=NC=C1)C(=O)C1=CC=C(Cl)C=C1)C1=CC=NC=C1
InChIKey
InChIKey=LYMJHYNBDHQPOS-UHFFFAOYSA-N
Formula
C42H32Cl3N3O4
Mass
749.09
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Alkyl-phenylketones Butyrophenones Aryl alkyl ketones Benzoyl derivatives Chlorobenzenes Pyridines and derivatives Aryl chlorides Beta-hydroxy ketones Heteroaromatic compounds Secondary alcohols Azacyclic compounds Organonitrogen compounds Organic oxides Organochlorides Aromatic alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Alkyl-phenylketone - Butyrophenone - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Beta-hydroxy ketone - Aryl halide - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Secondary alcohol - Ketone - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available