Compound Identification
SMILES
O=C(CC(=O)C1=CC=C(C=C1)C1=CC=C(C=C1)C1=NN=C(O1)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=ABTAPUPJOZZTCO-UHFFFAOYSA-N
Formula
C29H20N2O3
Mass
444.49
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
Retro-dihydrochalcones Alkyl-phenylketones Biphenyls and derivatives Butyrophenones Aryl alkyl ketones Benzoyl derivatives Beta-diketones 1,3,4-oxadiazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Aldehydes Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Retro-dihydrochalcone - Linear 1,3-diarylpropanoid - Alkyl-phenylketone - Biphenyl - Butyrophenone - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - 1,3-diketone - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Benzenoid - Azole - Heteroaromatic compound - 1,3,4-oxadiazole - Oxadiazole - Ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aldehyde - Organopnictogen compound - Organic oxide - 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