Compound Identification
SMILES
COC1=C(OC)C=C(CCN(CC2=CC=CO2)C(=O)CN(CCCN2CCOCC2)C(=O)C=CC2=CC=C(C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=KNTNDVAWDWGUBL-UHFFFAOYSA-N
Formula
C33H40N4O8
Mass
620.703
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
Alpha amino acids and derivatives Dimethoxybenzenes Nitrobenzenes Styrenes Phenoxy compounds Anisoles Nitroaromatic compounds Alkyl aryl ethers Morpholines Tertiary carboxylic acid amides Furans Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxoazanium compounds Organic zwitterions Organic salts Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Alpha-amino acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Styrene - Phenol ether - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Oxazinane - Morpholine - Tertiary carboxylic acid amide - Furan - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Organic nitro compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Carbonyl group - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic salt - 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