Structure Information
Structure

Compound Identification

SMILES

C[C@H]([C@@H](C[C@@H](OC(C)=O)C(C)(C)O)OC(C)=O)C1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CCC(=O)C4(C)C)[C@]3(C)CC[C@]12CO

InChIKey

InChIKey=VNEQIRWUIXRANF-RJQDIVEQSA-N

Formula

C34H54O7

Mass

574.799

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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 - Steroid ester - 18-hydroxysteroid - 3-oxo-delta-5-steroid - 3-oxosteroid - 14-alpha-methylsteroid - Oxosteroid - Hydroxysteroid - Delta-5-steroid - Dicarboxylic acid or derivatives - Tertiary alcohol - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Primary alcohol - 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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