Structure Information
Structure

Compound Identification

SMILES

CC(C)N(CCCN1C(SC2=CC3=C(OCO3)C=C2C2=CC=NN2)=NC2=C1N=CN=C2N)C(=S)NC1=CC(C(O)=O)=C(C=C1)C1=C2C=CC(=O)C=C2OC2=C1C=CC(O)=C2

InChIKey

InChIKey=LPQCFGJTYNXTLF-UHFFFAOYSA-N

Formula

C42H35N9O7S2

Mass

841.92

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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 - Diarylthioether - 6-aminopurine - N-phenylthiourea - Benzodioxole - Benzoic acid or derivatives - Benzoic acid - Imidazopyrimidine - Purine - Aryl thioether - Benzoyl - Thiophenol ether - Aminopyrimidine - 1-hydroxy-2-unsubstituted benzenoid - Imidolactam - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Primary aromatic amine - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Pyrazole - Amino acid or derivatives - Amino acid - Thiourea - Cyclic ketone - Thioether - Azacycle - Sulfenyl compound - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Primary amine - Organopnictogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - 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

Not available

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