Compound Identification
SMILES
F[B-](F)(F)F.CC[S+]1CC2=CC=CC=C2C(C(C)=O)=C1C1=CC=CC=C1
InChIKey
InChIKey=XJEFDMWCNPHBGY-UHFFFAOYSA-N
Formula
C19H19BF4OS
Mass
382.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Isothiochromenes 2-benzothiopyrans Benzene and substituted derivatives Ketones Organic metalloid salts Organosulfur compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Isothiochromene - 2-benzothiopyran - Benzothiopyran - Monocyclic benzene moiety - Benzenoid - Ketone - Organoheterocyclic compound - Organic metalloid salt - Organic salt - Organic zwitterion - Organosulfur compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available