Compound Identification
SMILES
OC[C@H]1O[C@@H](CC(=O)\C=C\C2=C(C=CC(=C2)C(F)(F)F)C(F)(F)F)[C@H](O)[C@@H](O)[C@H]1O
InChIKey
InChIKey=QZDFXKVMVQUQTR-HVGDMUFGSA-N
Formula
C18H18F6O6
Mass
444.326
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
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Subclass
Cinnamic acid esters
- Level 5 C-cinnamoyl glycosides
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Subclass
Cinnamic acid esters
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
C-cinnamoyl glycosides
Alternative Parents
Hexoses C-glycosyl compounds Trifluoromethylbenzenes Styrenes Oxanes Acryloyl compounds Enones 1,2-diols Secondary alcohols Ketones Oxacyclic compounds Dialkyl ethers Organofluorides Primary alcohols Hydrocarbon derivatives Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
C-cinnamoyl glycoside - Hexose monosaccharide - Glycosyl compound - C-glycosyl compound - Trifluoromethylbenzene - Styrene - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Oxane - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - 1,2-diol - Ketone - Secondary alcohol - Ether - Organoheterocyclic compound - Oxacycle - Dialkyl ether - Polyol - Organic oxygen compound - Organohalogen compound - Organofluoride - Organooxygen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Alcohol - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as c-cinnamoyl glycosides. These are c-glycoside derivatives of cinnamic acid. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available