Compound Identification
SMILES
OC1C(CC2=CC=C(C=C2)C2=CC=CC=C2)COC2=C1C=CC(=C2)C1=C(C=CC(Cl)=C1)C(O)=O
InChIKey
InChIKey=MYBPPTDUKUIWHM-UHFFFAOYSA-N
Formula
C29H23ClO4
Mass
470.95
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 Biphenyls and derivatives 1-benzopyrans 4-halobenzoic acids Halobenzoic acids Benzoic acids Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Secondary alcohols Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Homoisoflavan - Homoisoflavonoid - Biphenyl - Chromane - Benzopyran - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid - Halobenzoic acid - 1-benzopyran - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Halobenzene - Chlorobenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Ether - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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