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Structure Information
Structure

Compound Identification

SMILES

CC(C)(O)\C=C\C(=O)[C@](C)(O)C1[C@H](O)C(=O)[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C

InChIKey

InChIKey=UGRYXCKXFRMPOI-VYDLIQPASA-N

Formula

C30H44O8

Mass

532.674

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Cucurbitacins

Intermediate Tree Nodes

Not available

Direct Parent

Cucurbitacins

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Cucurbitacin skeleton - Triterpenoid - 25-hydroxysteroid - 22-oxosteroid - 21-oxosteroid - 20-hydroxysteroid - Hydroxysteroid - 3-hydroxy-delta-5-steroid - 16-hydroxysteroid - 16-alpha-hydroxysteroid - 3-alpha-hydroxysteroid - 2-hydroxysteroid - Oxosteroid - 14-alpha-methylsteroid - 3-hydroxysteroid - 15-oxosteroid - 11-oxosteroid - Delta-5-steroid - Acyloin - Acryloyl-group - Alpha-hydroxy ketone - Alpha,beta-unsaturated ketone - Cyclic alcohol - Tertiary alcohol - Enone - Secondary alcohol - Ketone - Polyol - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Alcohol - Organooxygen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cucurbitacins. These are polycyclic compounds containing the tetracyclic cucurbitane nucleus skeleton, 19-(10->9b)-abeo-10alanost-5-ene (also known as 9b-methyl-19-nor lanosta-5-ene), with a variety of oxygenation functionalities at different positions.

External Descriptors

Not available

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