Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H]1C(=O)C=C2[C@@H]3CC[C@@H]4C[C@H]5NC[C@H](O5)[C@]4(C)[C@H]3CC[C@]12C

InChIKey

InChIKey=YVWOGPJZTKNLJO-BYXPGVIDSA-N

Formula

C22H33NO2

Mass

343.511

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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

Samamine-type alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Samamine skeleton - 16-oxosteroid - Oxosteroid - Azasteroid - 2-oxasteroid - Naphthopyran - Naphthalene - Alkaloid or derivatives - Azepane - Pyran - Oxane - Oxazolidine - Cyclic ketone - Hemiaminal - Ketone - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Azacycle - Oxacycle - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as samamine-type alkaloids. These are alkaloids with a structure that is based on the samamine skeleton, a tetracyclic compound consisting of and azepane ring fuse a saturated cyclopenta[a]naphthalene derivative.

External Descriptors

Not available

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