Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C=CC(C=CC(=O)OC(C(=O)C=CC2=CC(OC)=C(O)C=C2)(C(=O)C=CC2=CC(OC)=C(O)C=C2)C2(OC3OC(CO)C(O)C(O)C3O)OC(CO)C(O)C2O)=C1

InChIKey

InChIKey=XTAIUHCIHUOSBW-UHFFFAOYSA-N

Formula

C42H46O20

Mass

870.81

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Curcuminoids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Curcumin - C-cinnamoyl glycoside - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Alkyl glycoside - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - C-glycosyl compound - Disaccharide - Glycosyl compound - O-glycosyl compound - Methoxyphenol - Methoxybenzene - Styrene - Anisole - Phenol ether - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - Ketal - Fatty acid ester - Phenol - Alpha-acyloxy ketone - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Oxane - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Acryloyl-group - Enone - Oxolane - Alpha,beta-unsaturated ketone - Carboxylic acid ester - Secondary alcohol - Ketone - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Polyol - Acetal - Monocarboxylic acid or derivatives - Oxacycle - Primary alcohol - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Aldehyde - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as curcuminoids. These are aromatic compounds containing a curcumin moiety, which is composed of two aryl buten-2-one (feruloyl) chromophores joined by a methylene group.

External Descriptors

Not available

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