Compound Identification
SMILES
C[C@@H](CS[C@@H](CCC1=CC=CC=C1C(C)=O)C1=CC=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=C1)C(O)=O
InChIKey
InChIKey=FVOPYCZWKWGZIS-YKSMYIBCSA-N
Formula
C32H30ClNO3S
Mass
544.11
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Linear 1,3-diarylpropanoids
Alternative Parents
Alkyl-phenylketones Chloroquinolines Acetophenones Styrenes Aryl alkyl ketones Benzoyl derivatives Pyridines and derivatives Aryl chlorides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Organochlorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,3-diarylpropanoid - Alkyl-phenylketone - Haloquinoline - Chloroquinoline - Quinoline - Acetophenone - Phenylketone - Benzoyl - Styrene - Aryl ketone - Aryl alkyl ketone - Aryl halide - Aryl chloride - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Ketone - Dialkylthioether - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
External Descriptors
Not available