Compound Identification
SMILES
O=C(C(C(=O)C1=CC=CC=C1)=C1SCCS1)C1=CC=CC=C1
InChIKey
InChIKey=XILIJTODMPBTMA-UHFFFAOYSA-N
Formula
C18H14O2S2
Mass
326.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
Subclass
Chalcones and dihydrochalcones
- Level 5 Retro-dihydrochalcones
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Subclass
Chalcones and dihydrochalcones
-
Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retro-dihydrochalcones
Alternative Parents
Butyrophenones Benzoyl derivatives Aryl ketones Vinylogous thioesters Enones Acryloyl compounds 1,3-dithiolanes Ketene acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retro-dihydrochalcone - Butyrophenone - Benzoyl - Aryl ketone - Benzenoid - Monocyclic benzene moiety - Vinylogous thioester - 1,3-dithiolane - Enone - Dithiolane - Acryloyl-group - Ketone - Ketene acetal or derivatives - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available