Structure Information
Structure

Compound Identification

SMILES

OCCOCCN(CCC#N)C1=NC(NC2=CC(=C(C=CC3=C(C=C(NC4=NC(NC5=C(C=CC(=C5)S(O)(=O)=O)S(O)(=O)=O)=NC(=N4)N(CCOCCO)CCC#N)C=C3)S(O)(=O)=O)C=C2)S(O)(=O)=O)=NC(NC2=C(C=CC(=C2)S(O)(=O)=O)S(O)(=O)=O)=N1

InChIKey

InChIKey=DUGTZBQIOAHTJU-UHFFFAOYSA-N

Formula

C46H50N14O22S6

Mass

1343.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Stilbenes

Subclass

Sulfonated stilbenes

Intermediate Tree Nodes

Not available

Direct Parent

Sulfonated stilbenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Sulfonated stilbene - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Styrene - Aniline or substituted anilines - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Heteroaromatic compound - Tertiary amine - Organoheterocyclic compound - Azacycle - Dialkyl ether - Ether - Carbonitrile - Nitrile - Secondary amine - Organonitrogen compound - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Primary alcohol - Organic oxide - Hydrocarbon derivative - Alcohol - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as sulfonated stilbenes. These are stilbenes that carry a sulfone group at one or more positions of either benzene rings.

External Descriptors

Not available

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