Compound Identification
SMILES
FC1=CC=C(C=C1)[C@@H]1CC2CCC(C1C1=CC=C(F)C=C1)N2CCCCC1=CC=CC=C1
InChIKey
InChIKey=HHGRRWHYCCTJGT-HKHBYEJGSA-N
Formula
C29H31F2N
Mass
431.571
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Phenyltropanes Stilbenes Phenylpiperidines Phenylbutylamines Fluorobenzenes Aralkylamines N-alkylpyrrolidines Aryl fluorides Trialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Phenyltropane - Stilbene - Phenylpiperidine - Phenylbutylamine - Tropane alkaloid - Fluorobenzene - Aralkylamine - Halobenzene - N-alkylpyrrolidine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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