Compound Identification
SMILES
CC1=CC=C(C=C1)C1CC(O)(C(C(C2=CC=C(C)C=C2)C1(C#N)C#N)C(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=WCIXCLURGHTUOE-UHFFFAOYSA-N
Formula
C35H30N2O2
Mass
510.637
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
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 Monocyclic monoterpenoids Aromatic monoterpenoids Benzoyl derivatives Aryl alkyl ketones Toluenes Cyclohexanols Tertiary alcohols Cyclic alcohols and derivatives Nitriles Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Alkyl-phenylketone - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Cyclohexanol - Toluene - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Cyclic alcohol - Ketone - Nitrile - Carbonitrile - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic 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