Compound Identification
SMILES
NC1=CC2=C(C=C1)C(C1=CC=C(C=C1)C#CC1=CC(C(=O)OCCCCCC(O)=O)=C(C=C1)C1=C3C=CC(=O)C=C3OC3=C1C=CC([O-])=C3)=C1C=CC(=N)C=C1O2
InChIKey
InChIKey=UFGCTOPFKIJHJH-UHFFFAOYSA-M
Formula
C47H33N2O8
Mass
753.788
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
-
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
Benzoic acid esters Benzoyl derivatives Medium-chain fatty acids Amino fatty acids Phenoxides Heterocyclic fatty acids Heteroaromatic compounds Amino acids Carboxylic acid esters Cyclic ketones Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Primary amines Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Medium-chain fatty acid - Amino fatty acid - Heterocyclic fatty acid - Phenoxide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Cyclic ketone - Amino acid - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Primary amine - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Amine - Organic anion - 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