Compound Identification
SMILES
[O-]C(=O)\C=C/C([O-])=O.[O-]C(=O)\C=C/C([O-])=O.CN1CCN(CCCOC2=CC=CC=C2O\C(=C/C2=CC=CC=C2)C(C)=O)CC1
InChIKey
InChIKey=MLHRFRWOUCPXFR-HXGLLMOZSA-J
Formula
C32H34N2O11
Mass
622.629
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
Phenoxy compounds Phenol ethers Alkyl aryl ethers N-methylpiperazines Unsaturated fatty acids Alpha-branched alpha,beta-unsaturated ketones Dicarboxylic acids and derivatives Acryloyl compounds Enones Trialkylamines Ketones Carboxylic acid salts Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Not available
Substituents
Cinnamic acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Dicarboxylic acid or derivatives - Piperazine - Unsaturated fatty acid - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acid - Fatty acyl - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid salt - Ketone - Carboxylic acid - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Azacycle - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Amine - Organonitrogen compound - Organic anion - Aromatic heteromonocyclic 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