Compound Identification
SMILES
COC(=O)CC1(CS[C@H](CCC2=CC=CC=C2[C@](C)(O)CO)C2=CC=CC(\C=C\C3=NC4=C(C=CC(Cl)=C4)C=C3)=C2)CC1
InChIKey
InChIKey=JJFSLYVCAWRHEX-DLWRZTCDSA-N
Formula
C36H38ClNO4S
Mass
616.21
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
Chloroquinolines Styrenes Fatty acid esters Aryl chlorides Pyridines and derivatives Tertiary alcohols Heteroaromatic compounds Methyl esters 1,2-diols Monocarboxylic acids and derivatives Dialkylthioethers Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Aromatic alcohols Primary alcohols Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,3-diarylpropanoid - Haloquinoline - Chloroquinoline - Quinoline - Styrene - Fatty acid ester - Aryl chloride - Fatty acyl - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Methyl ester - Tertiary alcohol - Carboxylic acid ester - 1,2-diol - Thioether - Organoheterocyclic compound - Dialkylthioether - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Sulfenyl compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alcohol - Aromatic alcohol - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Primary alcohol - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - 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