Structure Information
Structure

Compound Identification

SMILES

[H]C1(C)CC([H])(OC1=O)C1([H])CCC2([H])N1CC([H])(O)CCC21CC([H])(C)C(=O)O1

InChIKey

InChIKey=XGXUPXRXXQAJRW-UHFFFAOYSA-N

Formula

C18H27NO5

Mass

337.416

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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 - Pyrroloazepine - Azepane - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Oxolane - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Amine - Alcohol - 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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