Compound Identification
SMILES
COC1=C(C=CC(=C1)C1=NC=NC2=C1C=CC=C2C(C)C1=CC=C(F)C=C1)N1C=NC(C)=C1
InChIKey
InChIKey=NQIMJJLSSSVKQO-UHFFFAOYSA-N
Formula
C27H23FN4O
Mass
438.506
Taxonomic Classification
Taxonomy Tree
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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
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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
Phenylpyrimidines Phenylimidazoles Quinazolines Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fluorobenzenes Aryl fluorides N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - 4-phenylpyrimidine - 1-phenylimidazole - Quinazoline - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Benzenoid - Pyrimidine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Azacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic 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