Compound Identification
SMILES
CCOC(=O)C1=C(N(CCC2=CC(OC)=C(OCC3CO3)C=C2)C(C)C(C(O)=O)=C1C1=CC(=CC=C1)[N+]([O-])=O)C(F)(F)F
InChIKey
InChIKey=DJMBJZYYURMKSF-UHFFFAOYSA-N
Formula
C29H29F3N2O9
Mass
606.551
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acids
-
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
Dihydropyridinecarboxylic acids and derivatives Phenethylamines Nitrobenzenes Methoxybenzenes Phenoxy compounds Nitroaromatic compounds Anisoles Alkyl aryl ethers Aralkylamines Dicarboxylic acids and derivatives Vinylogous amides Enoate esters Trialkylamines Amino acids Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Epoxides Dialkyl ethers Enamines Carboxylic acids Organic oxoazanium compounds Organofluorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Alkyl fluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid - Phenethylamine - Nitrobenzene - Dihydropyridinecarboxylic acid derivative - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Dihydropyridine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Hydropyridine - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Vinylogous amide - Tertiary amine - C-nitro compound - Amino acid - Amino acid or derivatives - Carboxylic acid ester - Organic nitro compound - Tertiary aliphatic amine - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Azacycle - Dialkyl ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Enamine - Oxirane - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Organohalogen compound - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic cation - 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