Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CCC2[C@]3(C)CCC4C(C)(C)CCC[C@]4(COC(C)=O)C3CC[C@]2(C)[C@@H]1C=O

InChIKey

InChIKey=ASDDNTIFAUVZTF-RXHMZUAMSA-N

Formula

C28H42O5

Mass

458.639

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesterterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Scalarane sesterterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Scalarane sesterterpenoid - 17-oxosteroid - Oxosteroid - Steroid - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Aldehyde - Carbonyl group - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as scalarane sesterterpenoids. These are sesterterpenoids with a structure based on the scalarane backbone. Scalarane is a tetracyclic compound, which is similar the homoandrostane with five methyl groups at the 4-, 4-, 8-, 17-, 17a-positions.

External Descriptors

Not available

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