Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC1)C1=CC(=CC(=C1OCC1=CC=CC=C1)C(C)(C)C)C(O)\C=C\C1=CC(O)=C(C=C1)C(=O)OC(C#CC1=CC=C(C=C1)C(=O)OC(\C=C\C1=CC=C(C=C1)C(=O)OC(=O)C1=CC=C(\C=C\C(=O)C2=CC(=C(OCC3=CC=CC=C3)C(=C2)N2CCN(C)CC2)C(C)(C)C)C=C1)C1=CC(=C(OCC2=CC=CC=C2)C(=C1)N1CCN(C)CC1)C(C)(C)C)C1=CC(=C(OCC2=CC=CC=C2)C(=C1)N1CCN(C)CC1)C(C)(C)C

InChIKey

InChIKey=GXWNWUNQZDHDHD-IEKKDDQRSA-N

Formula

C128H142N8O14

Mass

2016.586

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Retrochalcones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Retrochalcone - Cinnamylphenol - Phenylpiperazine - N-arylpiperazine - Cinnamic acid or derivatives - O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Benzoate ester - Cinnamyl alcohol - Benzyloxycarbonyl - Phenylpropane - Aminophenyl ether - Benzoic acid or derivatives - Phenoxy compound - Styrene - Tertiary aliphatic/aromatic amine - Phenol ether - Benzoyl - Aryl ketone - Aniline or substituted anilines - Dialkylarylamine - N-methylpiperazine - N-alkylpiperazine - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1,4-diazinane - Monocyclic benzene moiety - Piperazine - Benzenoid - Acryloyl-group - Carboxylic acid anhydride - Vinylogous acid - Alpha,beta-unsaturated ketone - Enone - Ketone - Amino acid or derivatives - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid ester - Ether - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Aromatic alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

External Descriptors

Not available

Previous Back Next