Structure Information
Structure

Compound Identification

SMILES

CCOC1=C(OCC2=CC=C(O2)C(O)=O)C=CC(C=C2SC(=NC3=CC=CC=C3)N(CC3CCCO3)C2=O)=C1

InChIKey

InChIKey=IQSPFMRKBSBWMB-UHFFFAOYSA-N

Formula

C29H28N2O7S

Mass

548.61

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Furans

Subclass

Furoic acid and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Furoic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxy compound - Furoic acid - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Oxolane - Thiazolidine - Isothiourea - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as furoic acids. These are organic compounds containing a furoic acid moiety, with a structure characterized by a furan ring bearing a carboxylic acid group at the C2 or C3 carbon atom.

External Descriptors

Not available

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