Compound Identification
SMILES
COC1=CC=C(\C=C\C(=O)C2=CC=C(OCCO[C@H]3O[C@@H]4O[C@]5(C)CC[C@H]6[C@H](C)CC[C@@H]([C@H]3C)[C@@]46OO5)C=C2)C=C1
InChIKey
InChIKey=NPJZZLQFTKWIEU-QGALSRQGSA-N
Formula
C33H40O8
Mass
564.675
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 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
Artemisinins Cinnamic acids and derivatives Styrenes Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Aryl ketones Oxepanes Alkyl aryl ethers Trioxanes Oxanes Acryloyl compounds Enones Dialkyl peroxides Oxacyclic compounds Acetals Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Artemisinin skeleton - Sesquiterpenoid - Cinnamic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - Alkyl aryl ether - Oxepane - Benzenoid - 1,2,4-trioxane - Monocyclic benzene moiety - Oxane - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Dialkyl peroxide - Ketone - Ether - Acetal - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Aldehyde - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic 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