Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.CC(=N)N1CCC(CC1)OC1=CC=C(C=C1)C(=O)NCCOC1=C(\C=C\C(N)=O)C=CC(=C1)C(N)=N

InChIKey

InChIKey=XRPGCBRQGDPZDY-GSHWVVEBSA-N

Formula

C28H33F3N6O6

Mass

606.603

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Hydroxycinnamic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Coumaric acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Cinnamic acid amide - Coumaric acid or derivatives - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Styrene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Piperidine - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Amidine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid amidine - Carboximidamide - Carboxylic acid - Hydrocarbon derivative - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.

External Descriptors

Not available

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