Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(CBr)=C(C1C1=CC=CC2=C1OC1=CC=CC=C1C2=O)C(=O)OCC
InChIKey
InChIKey=TWWCNSYZBPKELU-UHFFFAOYSA-N
Formula
C26H24BrNO6
Mass
526.383
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
- 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 - Xanthenes
Direct Parent
Xanthones
Alternative Parents
Chromones Dihydropyridinecarboxylic acids and derivatives Pyranones and derivatives Benzenoids Dicarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Enoate esters Azacyclic compounds Oxacyclic compounds Dialkylamines Enamines Organobromides Alkyl bromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthone - Chromone - Dihydropyridinecarboxylic acid derivative - Dihydropyridine - Pyranone - Dicarboxylic acid or derivatives - Hydropyridine - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Oxacycle - Enamine - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Alkyl bromide - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthones. These are polycyclic aromatic compounds containing a xanthene moiety conjugated to a ketone group at carbon 9. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.
External Descriptors
Not available