Compound Identification
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.CC1=CC=C(C=C1)S(O)(=O)=O.CC1=CC=C(C=C1)[C@@H]1OC2=CC=CC=C2C(=O)[C@H]1[Tl]
InChIKey
InChIKey=BVYCUAYJXHMHRF-UFRNLTNDSA-N
Formula
C30H29O8S2Tl
Mass
786.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Flavonoids
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Subclass
Flavans
- Level 5 Flavanones
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Subclass
Flavans
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Class
Flavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavanones
Alternative Parents
p-Methylbenzenesulfonates Chromones Tosyl compounds Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Aryl alkyl ketones Alkyl aryl ethers Sulfonyls Organosulfonic acids Oxacyclic compounds Organothalium compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Flavanone - Chromone - P-methylbenzenesulfonate - Chromane - Benzopyran - Benzenesulfonate - Tosyl compound - 1-benzopyran - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Toluene - Benzenoid - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Organoheterocyclic compound - Ether - Oxacycle - Organosulfur compound - Organic post-transition metal moeity - Organometallic compound - Hydrocarbon derivative - Organic oxide - Organothalium compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavanones. These are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a ketone at the carbon C3.
External Descriptors
Not available