Structure Information
Structure

Compound Identification

SMILES

CC(C)C(CCOS(O)(=O)=O)CCC(C)[C@H]1[C@@H](O)C(O)C2[C@]1(C)CCC1[C@@]2(O)C[C@@H](O)C2(O)C[C@@H](O)CC[C@]12C

InChIKey

InChIKey=OXRBTTBRQHWZMG-YTPGVBLHSA-N

Formula

C29H52O10S

Mass

592.79

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Stigmastanes and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Stigmastanes and derivatives

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Triterpenoid - Stigmastane-skeleton - Sulfated steroid skeleton - 3-beta-hydroxysteroid - 16-hydroxysteroid - 16-beta-hydroxysteroid - Hydroxysteroid - 5-hydroxysteroid - 15-hydroxysteroid - 6-hydroxysteroid - 3-hydroxysteroid - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Tertiary alcohol - Organic sulfuric acid or derivatives - Cyclic alcohol - Secondary alcohol - 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 stigmastanes and derivatives. These are sterol lipids with a structure based on the stigmastane skeleton, which consists of a cholestane moiety bearing an ethyl group at the carbon atom C24.

External Descriptors

Not available

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