Compound Identification
SMILES
[Ti].OC1=CC=CC=C1C(=[OH+])[CH-]C(=[OH+])C1=CC=CC=C1.OC1=CC=CC=C1C(=[OH+])[CH-]C(=[OH+])C1=CC=CC=C1
InChIKey
InChIKey=ZALBTGNUBLLSJH-UHFFFAOYSA-R
Formula
C30H26O6Ti
Mass
530.398
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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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
2'-Hydroxy-dihydrochalcones Cinnamylphenols Butyrophenones Aryl ketones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organic transition metal salts Enolates Carboximidic acids Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Retro-dihydrochalcone - 2'-hydroxy-dihydrochalcone - Cinnamylphenol - Butyrophenone - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Organic transition metal salt - Carboximidic acid - Enolate - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic salt - Organic cation - Aromatic homomonocyclic 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