Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC.COC1=C(C=C(C=C1)C1=CC2=C(C=C1)C=C(C=C2)C(O)=O)C12CC3CC(CC(C3)C1)C2

InChIKey

InChIKey=PPRNFAYQHGSBTL-UHFFFAOYSA-N

Formula

C40H48O10

Mass

688.814

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Retinoids

Intermediate Tree Nodes

Not available

Direct Parent

Retinoids

Alternative Parents

Molecular Framework

Not available

Substituents

Adapalene - Phenylnaphthalene - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Naphthalene - Tricarboxylic acid or derivatives - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Carboxylic acid ester - Ether - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as retinoids. These are oxygenated derivatives of 3,7-dimethyl-1-(2,6,6-trimethylcyclohex-1-enyl)nona-1,3,5,7-tetraene and derivatives thereof.

External Descriptors

Not available

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