Structure Information
Structure

Compound Identification

SMILES

CC[C@]1(CC[C@@H](O1)[C@]1(C)CC[C@]2(C[C@H](OCC3=CC=C(Cl)C=C3)[C@@H](C)[C@@H](O2)[C@@H](C)[C@@H](OC)[C@H](C)C(O)=O)O1)[C@@H]1O[C@H](C[C@@H]1C)[C@H]1O[C@](O)([C@H](C)C[C@@H]1C)C(O)=O

InChIKey

InChIKey=VCICSCPJLJDHRA-IKTQLQBASA-N

Formula

C43H65ClO12

Mass

809.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Sugar acids and derivatives - Glucuronic acid derivatives - Glucuronides

Direct Parent

C-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

C-glucuronide - Benzylether - Ketal - Chlorobenzene - Halobenzene - Alpha-hydroxy acid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Oxane - Hydroxy acid - Dicarboxylic acid or derivatives - Oxolane - Hemiacetal - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Oxacycle - Ether - Organohalogen compound - Carbonyl group - Organochloride - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as c-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through a C-glycosidic bond.

External Descriptors

Not available

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