Structure Information
Structure

Compound Identification

SMILES

C[C@H]1C[C@H](OC1=O)[C@@H]1CC[C@@H]2[N@@H+]1CCCC[C@@]21C[C@H](C)C(=O)O1

InChIKey

InChIKey=FOGTVYCUHQOMDW-DFIGXFEKSA-O

Formula

C18H28NO4

Mass

322.424

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Stemona alkaloids

Subclass

Tuberostemospironine-type alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

Croomine-type alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Croomine-type alkaloid - Delta amino acid or derivatives - Pyrroloazepine - Azepane - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Pyrrolidine - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Lactone - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Azacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organic cation - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as croomine-type alkaloids. These are stemona alkaloids with a structure containing a pyrrolo[1,2-a]azepine group, where the azepine moiety forms a spiro system with oxolane-5-one to give spiro[oxolane-2,9'-pyrrolo[1,2-a]azepine]-5-one. Moreover, another 5-oxooxolane moiety attached to the pyrrole ring.

External Descriptors

Not available

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