Structure Information
Structure

Compound Identification

SMILES

[H][C@]1(O)CC[C@]2([H])CN3CCC4=C(NC5=CC=CC=C45)[C@]3([H])C[C@]2([H])[C@@]1([H])C(=O)OC

InChIKey

InChIKey=BLGXFZZNTVWLAY-FJDMERLMSA-N

Formula

C21H26N2O3

Mass

354.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Yohimbine alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Yohimbine alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Yohimbine - Corynanthean skeleton - Yohimbine alkaloid - Beta-carboline - Pyridoindole - 3-alkylindole - Indole - Indole or derivatives - Aralkylamine - Beta-hydroxy acid - Hydroxy acid - Benzenoid - Piperidine - Heteroaromatic compound - Methyl ester - Cyclic alcohol - Pyrrole - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Tertiary amine - Secondary alcohol - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organic oxygen compound - Alcohol - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as yohimbine alkaloids. These are alkaloids containing the pentacyclic yohimban skeleton. The Yohimbinoid alkaloids contain a carbocyclic ring E arising through C-17 to C-18 bond formation in a corynantheine precursor.

External Descriptors

CHEBI:48567 : methyl 17-hydroxy-20xi-yohimban-16-carboxylate

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