Compound Identification
SMILES
CC1=CC=C(S1)C(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C1=CC=CC=C1
InChIKey
InChIKey=LGMGMPROZWBSIR-UHFFFAOYSA-N
Formula
C22H16O4S
Mass
376.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Neoflavones
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Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Neoflavones
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavones
Alternative Parents
Coumarins and derivatives 1-benzopyrans Phenol ethers Aryl alkyl ketones Pyranones and derivatives Alkyl aryl ethers 2,5-disubstituted thiophenes Benzene and substituted derivatives Heteroaromatic compounds Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylcoumarin - Coumarin - Benzopyran - 1-benzopyran - Phenol ether - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Pyranone - 2,5-disubstituted thiophene - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Thiophene - Lactone - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavones. These are neoflavonoids with a structure based on the 4-phenylcoumarin skeleton.
External Descriptors
Not available