Structure Information
Structure

Compound Identification

SMILES

COC(=O)N[C@@H](C(C)C)C(=O)N1C[C@H](C)CC1C1=NC=C(N1)C1=CC=C(C=C1)C1=C2CCC3(CCCC3)C2=C(C=C1)C1=CC=C(C=C1)C1=CN=C(N1)[C@@H]1C[C@@H](C)CN1C(=O)[C@@H](NC(=O)OC)C(C)C

InChIKey

InChIKey=TXEMPNLVFDHZCZ-UCNSJEJASA-N

Formula

C55H68N8O6

Mass

937.199

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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 - Para-terphenyl - Terphenyl - Valine or derivatives - Alpha-amino acid amide - 5-phenylimidazole - 4-phenylimidazole - Alpha-amino acid or derivatives - Indane - N-acylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Imidazole - Carbamic acid ester - Tertiary carboxylic acid amide - Azole - Pyrrolidine - Methylcarbamate - Heteroaromatic compound - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - 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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