Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1C[C@H](C)O[C@@H](CC[C@H](C)[C@H](O)[C@H](C)[C@H]2OC(=O)\C=C\C(\C)=C\C[C@@H](C[C@@H]3O[C@@H](CC=C3)C[C@H](OC)[C@@H](C)[C@@H]3C[C@@H](OC(C)(C)O3)[C@H](C)[C@H](OC(=O)\C=C\C(\C)=C\C[C@@H](C[C@H]3O[C@@H](CC=C3)C[C@H](OC)[C@@H](C)[C@@H]3C[C@@H](OC(C)(C)O3)[C@@H]2C)OC(=O)C2=CC=C(Br)C=C2)[C@@H](C)[C@@H](OC(=O)C2=CC=C(Br)C=C2)[C@@H](C)CC[C@H]2C[C@@H](C[C@H](C)O2)OC)OC(=O)C2=CC=C(Br)C=C2)C1

InChIKey

InChIKey=RFKPHQWIVMFWQX-UPYASAECSA-N

Formula

C105H149Br3O23

Mass

2019.036

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Pentacarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pentacarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pentacarboxylic acid or derivatives - Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Ketal - Bromobenzene - Halobenzene - Benzenoid - Pyran - Oxane - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Meta-dioxane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Secondary alcohol - Lactone - Carboxylic acid ester - Acetal - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Hydrocarbon derivative - Alcohol - Organohalogen compound - Organobromide - Organic oxygen compound - Organic oxide - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pentacarboxylic acids and derivatives. These are carboxylic acids containing exactly five carboxyl groups.

External Descriptors

Not available

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