Structure Information
Structure

Compound Identification

SMILES

CC[C@@]12CCC[N+]3=C1C1=C(C4=C(C=CC(Cl)=C4)N1C(=C2)C(=O)OC)C(O)=C3

InChIKey

InChIKey=QZWLSSCPGDIUGF-NRFANRHFSA-O

Formula

C21H20ClN2O3

Mass

383.85

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Eburnan-type alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Eburnan-type alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Eburna alkaloid - Indolo[3,2-1de][1,5]naphthyridine - Beta-carboline - Pyridoindole - Alpha-amino acid or derivatives - Naphthyridine - Indole - Indole or derivatives - Hydroxypyridine - Aryl chloride - Aryl halide - Pyridine - Pyridinium - Benzenoid - Pyrrole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as eburnan-type alkaloids. These are alkaloids with a structure based on the eburnan skeleton, that arises from rearrangement of the aspidospermidine ring system, involving migration of C-21 from C-7 to C-2, fission of the 2,16-bond, and attachment of C-16 to N-1.

External Descriptors

Not available

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