Compound Identification
SMILES
COC(=O)CCC1=CC2=C(OC(=C2SC)C2=CC(OC)=C(OC)C=C2)C=C1
InChIKey
InChIKey=UUXMRMRWMBBVHO-UHFFFAOYSA-N
Formula
C21H22O5S
Mass
386.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
2-arylbenzofuran flavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
2-arylbenzofuran flavonoids
Alternative Parents
2-phenylbenzofurans Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Fatty acid esters Alkylarylthioethers Methyl esters Heteroaromatic compounds Furans Sulfenyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - Phenylbenzofuran - 2-phenylbenzofuran - Dimethoxybenzene - O-dimethoxybenzene - Benzofuran - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Fatty acid ester - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Methyl ester - Heteroaromatic compound - Furan - Carboxylic acid ester - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.
External Descriptors
Not available