Compound Identification
SMILES
CC1=C(C)C(C(=O)C2=CC(C)=C(OS(=O)(=O)C3=C(O)C=C(C=C3)C(O)=O)C(=C2)C2=CC=CC=C2)=C(CC2=CC=CC=C2)O1
InChIKey
InChIKey=BPCZZGUMONTTJP-UHFFFAOYSA-N
Formula
C34H28O8S
Mass
596.65
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
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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
Aryl-phenylketones Biphenyls and derivatives Benzenesulfonate esters Hydroxybenzoic acid derivatives Arylsulfonic acids and derivatives Benzenesulfonyl compounds Benzoic acids Phenoxy compounds 3-aroylfurans Benzoyl derivatives Toluenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Organosulfonic acid esters Heteroaromatic compounds Sulfonyls Oxacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Aryl-phenylketone - Biphenyl - Benzenesulfonate ester - Hydroxybenzoic acid - Benzenesulfonate - Benzenesulfonyl group - Benzoic acid or derivatives - Benzoic acid - Arylsulfonic acid or derivatives - Benzoyl - Aryl ketone - 3-aroylfuran - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Toluene - Phenol - Benzenoid - Organosulfonic acid ester - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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