Compound Identification
SMILES
CN1CCN(CC1)C1=CC=C(C=C1)C1=CC2=C(NC3=NC=CC(=C23)C2=C(F)C=C(C=C2)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=YECHHPQMVZSFCN-UHFFFAOYSA-N
Formula
C34H29FN4
Mass
512.632
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
Alpha carbolines Biphenyls and derivatives N-arylpiperazines Phenylpiperazines Phenylpyridines Indoles Pyrrolopyridines Aniline and substituted anilines Dialkylarylamines N-methylpiperazines Fluorobenzenes Aryl fluorides Heteroaromatic compounds Pyrroles Trialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Alpha-carboline - Biphenyl - Phenylpiperazine - N-arylpiperazine - 4-phenylpyridine - Indole - Indole or derivatives - Pyrrolopyridine - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Fluorobenzene - Halobenzene - N-alkylpiperazine - N-methylpiperazine - Pyridine - Piperazine - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen 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