Compound Identification
SMILES
CC(C)C1=C(\C=C\C(O)CC(O)CC([O-])=O)C(=CC(OCC2=CC=CS2)=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=NAZXDCWIGPUBAX-MDZDMXLPSA-M
Formula
C27H28FO5S
Mass
483.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Biphenyls and derivatives
Alternative Parents
Cinnamyl alcohols Cumenes Phenylpropanes Medium-chain hydroxy acids and derivatives Styrenes Medium-chain fatty acids Phenoxy compounds Phenol ethers Alkyl aryl ethers Beta hydroxy acids and derivatives Fluorobenzenes Halogenated fatty acids Heterocyclic fatty acids Hydroxy fatty acids Aryl fluorides Unsaturated fatty acids Heteroaromatic compounds Thiophenes Carboxylic acid salts Secondary alcohols Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organofluorides Organic oxides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Biphenyl - Cinnamyl alcohol - Cumene - Medium-chain hydroxy acid - Phenylpropane - Phenoxy compound - Medium-chain fatty acid - Styrene - Phenol ether - Alkyl aryl ether - Beta-hydroxy acid - Fluorobenzene - Halobenzene - Halogenated fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Aryl fluoride - Aryl halide - Fatty acyl - Fatty acid - Unsaturated fatty acid - Hydroxy acid - Thiophene - Heteroaromatic compound - Secondary alcohol - Carboxylic acid salt - Ether - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Alcohol - Organic oxygen compound - Organofluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organic anion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
External Descriptors
Not available