Structure Information
Structure

Compound Identification

SMILES

CCOC12CC(C)CNC1C(C)C1C(CC3C4CCC5CC(O)CCC5(C)C4CCC13C)O2

InChIKey

InChIKey=NVXKWXXBWXGHPN-UHFFFAOYSA-N

Formula

C29H49NO3

Mass

459.715

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroidal alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

Solanocapsine-type alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Solanocapsine skeleton - Aminoglycoside core - 3-hydroxysteroid - Hydroxysteroid - Azasteroid - Alkaloid or derivatives - Ketal - Oxane - Piperidine - Cyclic alcohol - Secondary alcohol - Oxacycle - Secondary amine - Acetal - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as solanocapsine-type alkaloids. These are steroidal alkaloids with a structure that is characterized by a docosahydronaphth[2,1:4',5']indene ring system fused to a pyrano[3,2-b]pyridine moiety.

External Descriptors

Not available

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