Compound Identification
SMILES
[Br-].C1C2=C(C3=C(C=C(C=C3)C3=CC(=CC(=C3)C3=CC=CC=C3)C3=CC=CC=C3)C(=C2)C2=CC(=CC(=C2)C2=CC=CC=C2)C2=CC=CC=C2)C2=C(C[N+]11CC3=C(C4=C(C=C(C=C4)C4=CC(=CC(=C4)C4=CC=CC=C4)C4=CC=CC=C4)C(=C3)C3=CC(=CC(=C3)C3=CC=CC=C3)C3=CC=CC=C3)C3=C(C1)C=C(C1=CC(=CC(=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=C3C=CC(=C1)C1=CC(=CC(=C1)C1=CC=CC=C1)C1=CC=CC=C1)C=C(C1=CC(=CC(=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=C2C=CC(=C1)C1=CC(=CC(=C1)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=VHHLRNHMXUJYDR-UHFFFAOYSA-M
Formula
C188H128BrN
Mass
2481.003
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Phenylnaphthalenes Biphenyls and derivatives Benzazepines Azepines Aralkylamines Tetraalkylammonium salts Azacyclic compounds Organic bromide salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Phenylnaphthalene - Biphenyl - Benzazepine - Naphthalene - Azepine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Quaternary ammonium salt - Tetraalkylammonium salt - Azacycle - Organoheterocyclic compound - Organic salt - Organic bromide salt - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic cation - 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