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Structure Information
Structure

Compound Identification

SMILES

CNC(=O)C1=C(OC2=CC(N(CCOP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)N3C=NC(=N3)C(N)=O)S(C)(=O)=O)=C(C=C12)C1CC1)C1=CC=C(F)C=C1

InChIKey

InChIKey=XNMRNHNRJYYKNN-MWYPNJJNSA-N

Formula

C30H34FN6O12PS

Mass

752.66

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

2-arylbenzofuran flavonoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

2-arylbenzofuran flavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-arylbenzofuran flavonoid - Lignan glycoside - Neolignan skeleton - Pentose phosphate - Pentose-5-phosphate - 2-phenylbenzofuran - Phenylbenzofuran - N-ribosyl-1,2,4-triazole - Glycosyl compound - N-glycosyl compound - Monosaccharide phosphate - Pentose monosaccharide - Sulfanilide - Benzofuran - 2-heteroaryl carboxamide - Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - Phosphoethanolamine - Fluorobenzene - Halobenzene - Dialkyl phosphate - Alkyl phosphate - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Monosaccharide - Organic phosphoric acid derivative - Benzenoid - Phosphoric acid ester - Organosulfonic acid amide - Organic sulfonic acid amide - Triazole - Furan - Sulfonyl - 1,2,4-triazole - Aminosulfonyl compound - Heteroaromatic compound - Organic sulfonic acid or derivatives - Oxolane - Organosulfonic acid or derivatives - Azole - Secondary alcohol - Secondary carboxylic acid amide - 1,2-diol - Carboxamide group - Primary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Alcohol - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.

External Descriptors

Not available

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