Structure Information
Structure

Compound Identification

SMILES

CCCNC1=C(O)C=C(\C=C(/C)C(=O)N[C@H]2[C@@H](O)[C@@H]3OCO[C@@H]3[C@H](O)[C@H]2O)C=C1

InChIKey

InChIKey=MIDDJVVTCMTMLO-ZKVKIDQDSA-N

Formula

C20H28N2O7

Mass

408.451

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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 - Cinnamic acid amide - O-aminophenol - Aniline or substituted anilines - Phenylalkylamine - Aminophenol - Secondary aliphatic/aromatic amine - Phenol - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Cyclitol or derivatives - Cyclic alcohol - Meta-dioxolane - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Acetal - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Secondary amine - Polyol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alcohol - Amine - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - 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

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