Compound Identification
SMILES
CC1=CC(CC2=CC(C)=C(OS(=O)(=O)C3=CC=CC4=C3C=CC([N+]#N)=C4O)C=C2C)=C(O)C(CC2=CC(C)=C(OS(=O)(=O)C3=CC=CC4=C3C=CC([N+]#N)=C4O)C=C2C)=C1
InChIKey
InChIKey=POBZXGVTMDAYAF-UHFFFAOYSA-P
Formula
C45H38N4O9S2
Mass
842.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
1-naphthalene sulfonates 1-naphthalene sulfonic acids and derivatives Diphenylmethanes Naphthols and derivatives Arylsulfonic acids and derivatives p-Xylenes Phenoxy compounds Para cresols Toluenes 1-hydroxy-4-unsubstituted benzenoids Organosulfonic acid esters Sulfonyls Organic diazonium salts Hydrocarbon derivatives Organic oxides Organooxygen compounds Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Diphenylmethane - 1-naphthol - Naphthalene - Arylsulfonic acid or derivatives - Phenoxy compound - P-cresol - P-xylene - Xylene - 1-hydroxy-4-unsubstituted benzenoid - Toluene - Phenol - Organosulfonic acid ester - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic diazonium salt - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homopolycyclic 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