Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C1=CC=CC=C1\C=N\NC1=NC=C(C=C1)C(=O)NCCCNC(=O)C1(CCCC1)C1=CC2=C(OCC(CC3=CC=C(C=C3)C3=CC=CC=C3)=C2)C=C1

InChIKey

InChIKey=GQRLEPLWXYSISK-YAUIOFPMSA-N

Formula

C44H43N5O6S

Mass

769.92

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Homoisoflavonoids

Subclass

Homoisoflavans

Intermediate Tree Nodes

Not available

Direct Parent

Homoisoflavans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Homoisoflavan - Biphenyl - Benzopyran - Benzenesulfonate - 1-benzopyran - Arylsulfonic acid or derivatives - Pyridine carboxylic acid or derivatives - Benzenesulfonyl group - Nicotinamide - 1-sulfo,2-unsubstituted aromatic compound - Alkyl aryl ether - Pyridine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Organosulfonic acid - Sulfonyl - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Hydrazone - Azacycle - Ether - Carboxylic acid derivative - Oxacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as homoisoflavans. These are homoisoflavonoids with a structure based on the chromane system. Chromone is a bicyclic compound consisting of a 3,4-dihydro-1-benzopyran.

External Descriptors

Not available

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