Compound Identification
SMILES
CCCCCOC(CCCC)C1=CC=CC(C2=CSC(NC(=O)C3=CC(F)=C(\C=C(/C)C(O)=O)C(F)=C3)=N2)=C1F
InChIKey
InChIKey=UHBSOVTXTOTVIC-NBVRZTHBSA-N
Formula
C30H33F3N2O4S
Mass
574.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acids
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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 acids
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids
Alternative Parents
3-halobenzoic acids and derivatives Benzamides Benzylethers Benzoyl derivatives 2,4-disubstituted thiazoles Fluorobenzenes Aryl fluorides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Organofluorides Hydrocarbon derivatives Organic oxides Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzylether - Benzoyl - Fluorobenzene - Halobenzene - 2,4-disubstituted 1,3-thiazole - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Thiazole - Azole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available