Structure Information
Structure

Compound Identification

SMILES

O[C@@H]([C@H]([C@H](NC1=CC=CC=N1)C1=CC=CC=C1NC(=O)COC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C1=CC=CC=N1)C1=CC=CC=C1

InChIKey

InChIKey=OTWZYMSDNGDKLP-BBYMZNSUSA-N

Formula

C33H34N4O9

Mass

630.654

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Linear 1,3-diarylpropanoids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Linear 1,3-diarylpropanoid - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Anilide - N-arylamide - Aminopyridine - Beta-hydroxy acid - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Hydroxy acid - Monosaccharide - Oxane - Pyran - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Acetal - Organoheterocyclic compound - Polyol - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Organopnictogen compound - Aromatic alcohol - Carbonyl group - Organic oxide - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.

External Descriptors

Not available

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