Structure Information
Structure

Compound Identification

SMILES

CC(C)(O)CCC(=O)C(C)(O)[C@H]1C(O)CC2(C)C3CC=C4C(CC(O)[C@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C

InChIKey

InChIKey=VVBWBGOEAVGFTN-MCPRMEHQSA-N

Formula

C30H48O7

Mass

520.707

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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

Triterpenoid - Cucurbitacin skeleton - 22-oxosteroid - 21-oxosteroid - Polyprenol skeleton - 20-hydroxysteroid - 3-beta-hydroxysteroid - 16-hydroxysteroid - 3-beta-hydroxy-delta-5-steroid - Oxosteroid - 11-oxosteroid - Hydroxysteroid - 2-hydroxysteroid - 3-hydroxysteroid - 3-hydroxy-delta-5-steroid - Delta-5-steroid - Acyloin - Tertiary alcohol - Cyclic alcohol - Alpha-hydroxy ketone - Secondary alcohol - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - 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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