Structure Information
Structure

Compound Identification

SMILES

C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O.CC(=O)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=CN=C3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1

InChIKey

InChIKey=YZKXSNLPAHKIHP-QJQQHHODSA-N

Formula

C46H56Cl2N4O6

Mass

831.88

Export to:

JSON SDF CSV

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

Retinoic acid - Retinoid skeleton - Diterpenoid - N-arylpiperazine - Phenylpiperazine - Aminophenyl ether - Medium-chain fatty acid - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Phenoxy compound - Aniline or substituted anilines - Phenol ether - 1,3-dichlorobenzene - Methyl-branched fatty acid - Chlorobenzene - Alkyl aryl ether - Halobenzene - Ketal - Branched fatty acid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - N-substituted imidazole - Piperazine - Fatty acyl - Fatty acid - Unsaturated fatty acid - Benzenoid - Azole - Tertiary carboxylic acid amide - Meta-dioxolane - Acetamide - Heteroaromatic compound - Imidazole - Tertiary amine - Amino acid or derivatives - Carboxamide group - Monocarboxylic acid or derivatives - Acetal - Ether - Oxacycle - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Amine - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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

Previous Back Next