Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(CCN(C)CC[C@](OC[C@@H]2CCCC3=C2C=CC(Cl)=C3)(C(C)C)C(O)=O)C=C1

InChIKey

InChIKey=BJUKTPSASCUKMF-IADCTJSHSA-N

Formula

C29H40ClNO5

Mass

518.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Tetralins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tetralins

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

O-dimethoxybenzene - Dimethoxybenzene - Tetralin - Phenethylamine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Amino fatty acid - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Amino acid - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Organooxygen compound - Organohalogen compound - Carbonyl group - Organochloride - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.

External Descriptors

Not available

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