Compound Identification
SMILES
[2H]C([2H])(C)C([2H])([2H])[C@@]1(CCC2=CC=CC=C2)CC(O[C@@H]2OC([C@@H](O)[C@H](O)[C@@H]2O)C(O)=O)=C([C@H](CC)C2=CC(NS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F)=CC=C2)C(=O)O1
InChIKey
InChIKey=ODSCYUCOVFARRF-OBRJYCGUSA-N
Formula
C37H41F3N2O11S
Mass
782.82
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
Kavalactones O-glucuronides O-glycosyl compounds Sulfanilides Pyridinesulfonamides Phenylpropanes Beta hydroxy acids and derivatives Dihydropyranones Dicarboxylic acids and derivatives Monosaccharides Oxanes Organosulfonamides Vinylogous esters Enoate esters Heteroaromatic compounds Aminosulfonyl compounds Lactones Secondary alcohols Polyols Acetals Carboxylic acids Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Carbonyl compounds Alkyl fluorides Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Kavalactone - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Pyridine-2-sulfonamide - Sulfanilide - Phenylpropane - Beta-hydroxy acid - Dihydropyranone - Benzenoid - Monosaccharide - Oxane - Organosulfonic acid amide - Hydroxy acid - Pyran - Dicarboxylic acid or derivatives - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary alcohol - Carboxylic acid ester - Lactone - Polyol - Carboxylic acid derivative - Carboxylic acid - Acetal - Organoheterocyclic compound - Azacycle - Oxacycle - Organofluoride - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alkyl fluoride - Alkyl halide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Carbonyl group - 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