Structure Information
Structure

Compound Identification

SMILES

COC1=C(CC=C(C)CC(C(O)OCCN2CCOCC2)C(O)=O)C(O)=C2C(=O)OCC2=C1C

InChIKey

InChIKey=HRJAOANATKGCMM-UHFFFAOYSA-N

Formula

C24H33NO9

Mass

479.526

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isocoumarans

Subclass

Isobenzofuranones

Intermediate Tree Nodes

Not available

Direct Parent

Phthalides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalide - Anisole - Medium-chain fatty acid - Alkyl aryl ether - Amino fatty acid - Beta-hydroxy acid - Branched fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Methyl-branched fatty acid - Oxazinane - Benzenoid - Fatty acid - Fatty acyl - Unsaturated fatty acid - Hydroxy acid - Morpholine - Dicarboxylic acid or derivatives - Vinylogous acid - Amino acid or derivatives - Amino acid - Carboxylic acid ester - Hemiacetal - Tertiary aliphatic amine - Lactone - Tertiary amine - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Amine - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalides. These are compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,.

External Descriptors

Not available

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