Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C#CC1=CC2=C(C=C1)N(C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O)C(=O)C21C(C2N(C1C1=CC=CC=C1OCCO)C(C(OC2=O)C1=CC=CC=C1)C1=CC=CC=C1)C(=O)NC1=NC2=CC=CC=C2S1

InChIKey

InChIKey=YFYKUPUHPTZVMN-UHFFFAOYSA-N

Formula

C59H45N5O11S

Mass

1032.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Linear diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Stilbene - Alpha-amino acid ester - Phenylmorpholine - Indolecarboxylic acid derivative - Indolecarboxylic acid - 2-phenylpyrrolidine - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Indole or derivatives - 1,3-benzothiazole - Anisole - Pyrrolidine-3-carboxamide - N-arylamide - Phenol ether - Nitroaromatic compound - Phenoxy compound - Methoxybenzene - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Morpholine - Benzenoid - Oxazinane - N-alkylpyrrolidine - Azole - Heteroaromatic compound - Dicarboximide - Carbamic acid ester - Thiazole - Pyrrole - Pyrrolidine - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Lactone - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Ether - Azacycle - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic salt - Organic nitrogen compound - Alcohol - Organonitrogen compound - Amine - Primary alcohol - Organooxygen compound - Organic zwitterion - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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