Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=CC2=C(C=C1)C(=C1C=CC(C(OCCOC3=C(C=CC(C)=C3)N(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O)=C1)=[N+](CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O)C1=C(O2)C=C(C=C1)N(C)C

InChIKey

InChIKey=WVFBOQGCAKHVGN-UHFFFAOYSA-N

Formula

C52H59N4O19

Mass

1044.052

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Dibenzopyrans

Direct Parent

Xanthenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Xanthene - Alpha-amino acid ester - Diaryl ether - Alpha-amino acid or derivatives - Aminophenyl ether - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aminotoluene - Aniline or substituted anilines - Alkyl aryl ether - Toluene - Acylal - Benzenoid - Monocyclic benzene moiety - Azomethine - Secondary ketimine - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Ether - Carboxylic acid derivative - Oxacycle - Acetal - Organonitrogen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.

External Descriptors

CHEBI:52892 : xanthene dye - iminium ion

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