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Structure Information
Structure

Compound Identification

SMILES

CCCCCCN(CCCCCC)C1=CC2=C(C=C1)C1=C(C(=O)O2)C(=O)C(\C=C\C2=[N+](CCCCC(O)=O)C3=C(C=C(C=C3)S(O)(=O)=O)C2(C)C)C(=O)O1

InChIKey

InChIKey=QAFJNEJOJGFPAS-XUTLUUPISA-O

Formula

C41H51N2O10S

Mass

763.92

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Coumarino-gamma-pyrones

Intermediate Tree Nodes

Not available

Direct Parent

Coumarino-gamma-pyrones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumarino-gamma-pyrone - Pyranocoumarin - Angular pyranocoumarin - Benzopyran - 1-benzopyran - 3-alkylindole - Arylsulfonic acid or derivatives - Indole or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aryl ketone - Aryl alkyl ketone - Pyranone - Benzenoid - Dicarboxylic acid or derivatives - Pyran - 1,3-dicarbonyl compound - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Carboxylic acid ester - Amino acid or derivatives - Ketone - Lactone - Amino acid - Tertiary amine - Carboxylic acid - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Oxacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumarino-gamma-pyrones. These are organic compounds with a structure characterized by the presence of a pyrano[3,2-c]chromene that carries two ketone groups at the 4- and 5-positions.

External Descriptors

Not available

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