Compound Identification
SMILES
CCOC(=O)C1=CN=C(C=C1)C#CC1=CC2=C(SCCC2(C)C)C=C1.CC[C@@H]1\C=C(C)\C[C@H](C)C[C@H](OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]([C@H](C)[C@@H](O)CC1=O)C(\C)=C\[C@@H]1CC[C@H](Cl)[C@@H](C1)OC
InChIKey
InChIKey=LQJWGYMSQIFYOT-MNZFELGNSA-N
Formula
C64H89ClN2O13S
Mass
1161.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Retinoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Retinoids
Intermediate Tree Nodes
Not available
Direct Parent
Retinoids
Alternative Parents
Macrolide lactams Alpha amino acid esters Macrolides and analogues Thiochromanes 1-benzothiopyrans Pyridinecarboxylic acids Alkylarylthioethers Cyclohexyl halides Thiopyrans Piperidines Oxanes Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Carboxylic acid esters Cyclic ketones Hemiacetals Lactams Lactones Oxacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Alkyl chlorides Organonitrogen compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Not available
Substituents
Tazarotene - Macrolide lactam - Alpha-amino acid ester - Macrolide - Alpha-amino acid or derivatives - Thiochromane - 1-benzothiopyran - Benzothiopyran - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aryl thioether - Cyclohexyl halide - Alkylarylthioether - Oxane - Piperidine - Pyridine - Thiopyran - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Cyclic ketone - Carboxamide group - Carboxylic acid ester - Hemiacetal - Ketone - Lactam - Lactone - Secondary alcohol - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Dialkyl ether - Ether - Thioether - Organoheterocyclic compound - Organochloride - Carbonyl group - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Alcohol - Alkyl chloride - Organic oxygen compound - Organohalogen compound - Alkyl halide - Aromatic heteropolycyclic 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