Structure Information
Structure

Compound Identification

SMILES

OC([C@H]1O[C@]([O-])(C(=O)C2=CC(O)=C(O)C(O)=C2)[C@@](O)(C(=O)C2=CC(O)=C(O)C(O)=C2)[C@](O)(C(=O)C2=CC(O)=C(O)C(O)=C2)[C@@]1(O)C(=O)C1=CC(O)=C(O)C(O)=C1)C(=O)C1=CC(C(=O)C2=CC(O)=C(O)C(O)=C2)=C(O)C(O)=C1

InChIKey

InChIKey=PWHHGTLUDWKYOT-PUKXYSGDSA-N

Formula

C48H35O29

Mass

1075.78

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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

Linear diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Benzophenone - Alkyl-phenylketone - Aryl-phenylketone - Diphenylmethane - C-glycosyl compound - Glycosyl compound - Secoiridoid-skeleton - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Benzenetriol - Phenylketone - Pyrogallol derivative - Benzoyl - Catechol - Aryl alkyl ketone - Aryl ketone - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Pyran - Oxane - Monosaccharide - Monocyclic benzene moiety - Acyloin - Tertiary alcohol - Alpha-hydroxy ketone - Vinylogous acid - Secondary alcohol - Ketone - Polyol - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Alkoxide - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic anion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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