Compound Identification
SMILES
OC[C@H]1OC([C@H](OC(=O)\C=C\C2=CC=C(O)C=C2)[C@@H](O)[C@@H]1O)C1=C(O)C=C2OC3=CC(O)=C(O)C=C3C(=O)C2=C1O
InChIKey
InChIKey=IEOFCWJJHJJKMH-SBEILVGRSA-N
Formula
C28H24O13
Mass
568.487
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
- Level 5 Dibenzopyrans
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Subclass
1-benzopyrans
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Class
Benzopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans - Xanthenes
Direct Parent
Xanthones
Alternative Parents
Phenolic glycosides Coumaric acid esters Cinnamic acid esters Coumaric acids and derivatives C-glycosyl compounds Chromones Styrenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Pyranones and derivatives Fatty acid esters Oxanes Monosaccharides Enoate esters Vinylogous acids Heteroaromatic compounds 1,2-diols Secondary alcohols Monocarboxylic acids and derivatives Dialkyl ethers Oxacyclic compounds Organic oxides Carbonyl compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenolic glycoside - Xanthone - Coumaric acid ester - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - C-glycosyl compound - Chromone - Glycosyl compound - Styrene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Fatty acid ester - Phenol - Pyranone - Pyran - Monocyclic benzene moiety - Oxane - Benzenoid - Monosaccharide - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Vinylogous acid - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Carboxylic acid ester - Polyol - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Primary alcohol - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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