Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OCC(O)=O)C(=O)\C=C\C1=CC(OC)=C(OC)C(=C1)C1=CC=CS1
InChIKey
InChIKey=BIVLMAWYQBHKIA-BQYQJAHWSA-N
Formula
C25H24O8S
Mass
484.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
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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
Retrochalcones
Alternative Parents
Cinnamic acids and derivatives Phenoxyacetic acid derivatives Dimethoxybenzenes Styrenes Phenoxy compounds Anisoles Aryl ketones Benzoyl derivatives Alkyl aryl ethers Acryloyl compounds Thiophenes Heteroaromatic compounds Enones Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Phenoxyacetate - Dimethoxybenzene - O-dimethoxybenzene - M-dimethoxybenzene - Benzoyl - Phenoxy compound - Phenol ether - Methoxybenzene - Styrene - Aryl ketone - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available