Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)[C@@H](N1CCOCC1)C1=CNC2=C1C=C(NC(=O)[C@H]1CC=CC[C@H]1C([O-])=O)C=C2

InChIKey

InChIKey=AISBDOYXQQYBGB-KHYOSLBOSA-L

Formula

C22H23N3O6

Mass

425.442

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolyl carboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Indole-3-acetic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole-3-acetic acid derivative - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - 3-alkylindole - Indole - N-arylamide - Aralkylamine - Dicarboxylic acid or derivatives - Morpholine - Oxazinane - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid salt - Amino acid - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Carboxylic acid - Dialkyl ether - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.

External Descriptors

Not available

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