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Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@]12CC3=C(C(O)C[C@H]1[C@H](C[N+](C)=C2)C(C)O)N(C)C1=CC=CC=C31

InChIKey

InChIKey=CWWCUWKAPAZFLA-XPBIWGEESA-N

Formula

C22H29N2O4

Mass

385.483

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Ervatamia alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Ervatamia alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Ervatamia skeleton - N-alkylindole - 3-alkylindole - Indole - Indole or derivatives - Tetrahydropyridine - N-methylpyrrole - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Methyl ester - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Alcohol - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ervatamia alkaloids. These are alkaloids with a structure based on the tetracyclic ervatamia skeleton, which arises from the 5,6- bond cleavage and 6,16- bond formation in the vobasine skeleton.

External Descriptors

Not available

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