Structure Information
Structure

Compound Identification

SMILES

CC(CCC(=C)C(C)(C)C)[C@H]1CC[C@@]2(C)[C@@H]3C[C@H](OS(O)(=O)=O)[C@H]4C[C@H](OS(O)(=O)=O)[C@H](C[C@]4(C)C3=CC[C@]12C)OS(O)(=O)=O

InChIKey

InChIKey=BINAUFPVSICZTQ-GXLPLFOCSA-N

Formula

C30H50O12S3

Mass

698.9

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Ergostane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Ergostane steroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Ergostane-skeleton - Sulfated steroid skeleton - 14-alpha-methylsteroid - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Organic sulfuric acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as ergostane steroids. These are steroids with a structure based on the ergostane skeleton, which arises from the methylation of cholestane at the 24-position.

External Descriptors

Not available

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