Compound Identification
SMILES
OC(=O)C1=CC(C(O)=O)=C(C=C1)C1=C2C=CC(=O)C=C2OC2=C1C=CC(O)=C2CNC(=O)C1=CC(=C(C=C1)C(O)=O)C1=C2C=C3CCC[N+]4=C3C(CCC4)=C2OC2=C3CCCN4CCCC(C=C12)=C34
InChIKey
InChIKey=KDBWTTSCZYQVPA-UHFFFAOYSA-O
Formula
C55H44N3O11
Mass
922.966
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
M-phthalic acid and derivatives Diarylethers Hydroquinolines Benzamides Benzoic acids Dialkylarylamines Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Heteroaromatic compounds Secondary carboxylic acid amides Cyclic ketones Amino acids Oxacyclic compounds Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Meta_phthalic_acid - Diaryl ether - Tetrahydroquinoline - Benzamide - Benzoic acid or derivatives - Benzoic acid - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Benzoyl - Aralkylamine - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxamide group - Cyclic ketone - Amino acid - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - 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
Not available