Compound Identification
SMILES
COC1=CC(OC)=C(CN2CCCCC2)C(O)=C1C(=O)\C=C\C1=CC(Br)=CC=C1
InChIKey
InChIKey=MYGIOVRZEHOPRQ-MDZDMXLPSA-N
Formula
C23H26BrNO4
Mass
460.368
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 2'-Hydroxychalcones
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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
2'-Hydroxychalcones
Alternative Parents
Cinnamylphenols N-benzylpiperidines Cinnamic acids and derivatives Dimethoxybenzenes Methoxyphenols Anisoles Aryl ketones Benzoyl derivatives Benzylamines Styrenes Phenylmethylamines Phenoxy compounds Bromobenzenes 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Aryl bromides Vinylogous acids Enones Acryloyl compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2'-hydroxychalcone - Cinnamylphenol - N-benzylpiperidine - Benzylpiperidine - Cinnamic acid or derivatives - Methoxyphenol - Dimethoxybenzene - M-dimethoxybenzene - Methoxybenzene - Styrene - Phenylmethylamine - Benzoyl - Benzylamine - Phenol ether - Aryl ketone - Anisole - Phenoxy compound - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Halobenzene - Aralkylamine - Bromobenzene - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Piperidine - Benzenoid - Acryloyl-group - Vinylogous acid - Alpha,beta-unsaturated ketone - Enone - Ketone - Tertiary amine - Tertiary aliphatic amine - Ether - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2'-hydroxychalcones. These are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position.
External Descriptors
Not available