Structure Information
Structure

Compound Identification

SMILES

OC[C@H]1O[C@@H](O[C@@H]2OC=C3[C@@H](C[C@H](OC(=O)\C=C\C4=CC(O)=C(O)C=C4)OC3=O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O

InChIKey

InChIKey=JZAJSJKWOPTXFR-JOWODZTASA-N

Formula

C25H28O13

Mass

536.486

Export to:

JSON SDF CSV

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

Aromatic heteropolycyclic compounds

Substituents

Coumaric acid or derivatives - Hexose monosaccharide - Cinnamic acid ester - Glycosyl compound - O-glycosyl compound - Catechol - Styrene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Delta valerolactone - Fatty acid ester - Acylal - Delta_valerolactone - Phenol - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Monosaccharide - Benzenoid - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Secondary alcohol - Lactone - Carboxylic acid ester - Polyol - Acetal - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Organooxygen compound - Primary alcohol - Organic oxide - Hydrocarbon derivative - Alcohol - Carbonyl group - Aromatic heteropolycyclic 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

Previous Back Next