Compound Identification
SMILES
COC1=CC(CCC2=CC(=C(OC)C=C2)C2=C(OC)C=CC(CCC3=CC(OC)=C(OS(=O)(=O)C(F)(F)F)C=C3)=C2)=C(C=C1)B1OC(C)(C)C(C)(C)O1
InChIKey
InChIKey=IBQCIOWMAZEPLD-UHFFFAOYSA-N
Formula
C39H44BF3O9S
Mass
756.64
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
Stilbenes Biphenyls and derivatives Trifluoromethanesulfonates Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Sulfonic acid esters Organosulfonic acid esters Sulfonyls Boronic acid esters Dioxaborolanes Methanesulfonates Trihalomethanes Oxacyclic compounds Organic metalloid salts Hydrocarbon derivatives Alkyl fluorides Organometalloid compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Stilbene - Biphenyl - Phenoxy compound - Trifluoromethanesulfonate - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Sulfonic acid ester - Benzenoid - Organosulfonic acid ester - Boronic acid ester - 1,3,2-dioxaborolane - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Trihalomethane - Boronic acid derivative - Organoheterocyclic compound - Organic metalloid salt - Oxacycle - Ether - Organosulfur compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organohalogen compound - Halomethane - Organic metalloid moeity - Organofluoride - Organic oxide - Organooxygen 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