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Structure Information
Structure

Compound Identification

SMILES

COC(CO)[C@@H]1CC2[C@@H](CC3CNC4=CC=CC2=C34)N(C)C1

InChIKey

InChIKey=HNVGYCBCWFDPPO-MIZLEEOUSA-N

Formula

C18H26N2O2

Mass

302.418

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

6,7-secoergolines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

6,7-secoergolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6,7-secoergoline - Ergoline skeleton - Benzoquinoline - Tetralin - Quinoline - Indole or derivatives - Dihydroindole - Isoindole or derivatives - Aralkylamine - Secondary aliphatic/aromatic amine - Benzenoid - Piperidine - Tertiary aliphatic amine - Tertiary amine - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Secondary amine - Amine - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6,7-secoergolines. These are compounds containing a tricyclic ergoline analog, where carbon atoms C6 and C7 are not linked to each other.

External Descriptors

Not available

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