Compound Identification
SMILES
CC[C@@H](CC1=CC(=CC=C1)C(F)(F)F)[C@@H]1OC(=O)C([C@@H](C2CC2)C2=CC=CC=C2)=C(O)C1=O
InChIKey
InChIKey=ZLECQQPVTJGHIN-GANZUKCXSA-N
Formula
C26H25F3O4
Mass
458.477
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
Trifluoromethylbenzenes Dihydropyranones Alpha-acyloxy ketones Vinylogous acids Enoate esters Lactones Cyclic ketones Oxacyclic compounds Monocarboxylic acids and derivatives Enols Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Trifluoromethylbenzene - Dihydropyranone - Alpha-acyloxy ketone - Monocyclic benzene moiety - Pyran - Benzenoid - Vinylogous acid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Monocarboxylic acid or derivatives - Enol - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organofluoride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Carbonyl group - Organooxygen compound - Alkyl halide - 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