Compound Identification
SMILES
CC1=C(O[C@@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)OC=CC1=O
InChIKey
InChIKey=JRUMXTPQUYPUHC-WPQZBVJZSA-N
Formula
C21H22O9
Mass
418.398
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
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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 acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
O-glycosyl compounds Styrenes Fatty acid esters Pyranones and derivatives Monosaccharides Oxanes Enoate esters Vinylogous esters Heteroaromatic compounds Secondary alcohols Cyclic ketones Monocarboxylic acids and derivatives Acetals Polyols Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid ester - Glycosyl compound - O-glycosyl compound - Styrene - Fatty acid ester - Pyranone - Monocyclic benzene moiety - Monosaccharide - Oxane - Pyran - Fatty acyl - Benzenoid - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Heteroaromatic compound - Secondary alcohol - Cyclic ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Polyol - Acetal - Organooxygen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available