Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=C2OC3(SC4=CC=CC=C4S3)C(=CC2=C1)C1=CC=CC2=CC=CC=C12)[N+]([O-])=O

InChIKey

InChIKey=WEVRSJMTQSSVQD-UHFFFAOYSA-N

Formula

C26H17NO4S2

Mass

471.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

6-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-methoxyisoflavonoid-skeleton - Isoflav-3-ene skeleton - Benzopyran - Naphthalene - 1-benzopyran - Methoxyaniline - Anisole - Aryl thioether - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Benzenoid - Monothioacetal - Dithiole - 1,3-dithiole - Organic nitro compound - C-nitro compound - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C6 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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