Compound Identification
SMILES
OC1C(CC2=CC=CC=C2)COC2=C1C=CC(=C2)C1=C(C=CC(=C1)C(F)(F)F)C(O)=O
InChIKey
InChIKey=NZQDWKCNBOELAI-UHFFFAOYSA-N
Formula
C24H19F3O4
Mass
428.407
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Homoisoflavans Trifluoromethylbenzenes 1-benzopyrans Benzoic acids Benzoyl derivatives Alkyl aryl ethers Secondary alcohols Oxacyclic compounds Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Homoisoflavan - Homoisoflavonoid - Chromane - Benzopyran - Trifluoromethylbenzene - 1-benzopyran - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxide - Alcohol - Organohalogen compound - Organofluoride - Organooxygen compound - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available