Structure Information
Structure

Compound Identification

SMILES

[Na+].CCCCCCN(CCCCCC)C1=CC2=C(C=C1)C1=C(C(=O)O2)C(=O)C(\C=C\C=C\C2=C3C=CC(C=C3OC(=C2)C(C)(C)C)=[N+](CCCS([O-])(=O)=O)CCCS([O-])(=O)=O)C(=O)O1

InChIKey

InChIKey=XVJXOSWGDSUKFM-VIWUVAGBSA-M

Formula

C47H59N2NaO12S2

Mass

931.1

Export to:

JSON SDF CSV

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 - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aryl alkyl ketone - Aryl ketone - Pyranone - Pyran - 1,3-dicarbonyl compound - Benzenoid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Alkanesulfonic acid - Secondary ketimine - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactone - Tertiary amine - Organic alkali metal salt - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic zwitterion - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organic sodium salt - Hydrocarbon derivative - Organic salt - Carbonyl group - 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

Previous Back Next