Compound Identification
SMILES
C[NH+]=C1C=CC2=C(C3=CC=CC=C3C(O)=O)C3=C(OC2=C1)C=C(NC1=C(C)C=C(C=C1)S([O-])(=O)=O)C=C3
InChIKey
InChIKey=JGGYIJVRRBGDKN-UHFFFAOYSA-N
Formula
C28H22N2O6S
Mass
514.55
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
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Level 5
Dibenzopyrans
- Level 6 Xanthenes
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Level 5
Dibenzopyrans
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Subclass
1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans
Direct Parent
Xanthenes
Alternative Parents
Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Benzoic acids Aminotoluenes Aniline and substituted anilines Benzoyl derivatives Primary aromatic amines Sulfonyls Secondary ketimines Organosulfonic acids Heteroaromatic compounds Amino acids Carboxylic acids Oxacyclic compounds Secondary amines Organic zwitterions Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzoic acid or derivatives - Benzenesulfonyl group - Benzoic acid - 1-sulfo,2-unsubstituted aromatic compound - Benzoyl - Aminotoluene - Aniline or substituted anilines - Toluene - Monocyclic benzene moiety - Primary aromatic amine - Benzenoid - Heteroaromatic compound - Secondary ketimine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amino acid or derivatives - Amino acid - Oxacycle - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organic salt - 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