Structure Information
Structure

Compound Identification

SMILES

CCC(C)C1N(C(=O)C(NC(=O)C2CN(C)C3CC4=CNC5=CC=CC(=C45)C3=C2)C(C)C)C(=O)C2CCCN2C1=O

InChIKey

InChIKey=HKVSEIVDIONNKB-UHFFFAOYSA-N

Formula

C32H41N5O4

Mass

559.711

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Ergoline and derivatives

Subclass

Lysergic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Ergopeptams

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Ergopeptam-skeleton - Hybrid peptide - Alpha-dipeptide - Lysergic acid amide - Indoloquinoline - Benzoquinoline - Valine or derivatives - Quinoline-3-carboxamide - Pyrroloquinoline - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 3-alkylindole - Quinoline - Alpha-amino acid or derivatives - Isoindole or derivatives - Indole or derivatives - Indole - 2,5-dioxopiperazine - Dioxopiperazine - Aralkylamine - N-alkylpiperazine - Benzenoid - Piperazine - Carboxylic acid imide, n-substituted - 1,4-diazinane - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrolidine - Pyrrole - Dicarboximide - Carboxylic acid imide - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Lactam - Carboxamide group - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ergopeptams. These are tripeptidic noncyclol ergot alkaloids. The structure of ergopeptams is similar to ergopeptines except that L-proline is exchanged by D-proline, and the tripeptide chain is a noncyclol lactam.

External Descriptors

Not available

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