Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C/C(O)=O.CC(C)N1C=C2C[C@@H]3[C@H](C=C(COC(=O)C4CCC4)CN3C)C3=C2C1=CC=C3

InChIKey

InChIKey=UXEQLDJMBAKLER-IQVRMLRVSA-N

Formula

C28H34N2O6

Mass

494.588

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Ergoline and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Ergoline and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Ergoline skeleton - Benzoquinoline - Pyrroloquinoline - N-alkylindole - Quinoline - 3-alkylindole - Indole - Indole or derivatives - Isoindole or derivatives - Aralkylamine - Dicarboxylic acid or derivatives - Benzenoid - Fatty acid - Unsaturated fatty acid - Fatty acyl - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ergoline and derivatives. These are compounds containing an ergoline moiety, which is structurally characterized by he presence of a 4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg] quinoline.

External Descriptors

Not available

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