Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].[Na+].C[C@H](CCC(C)C1=CC(=O)OC1O)[C@H]1CC[C@@]2(C)[C@@H]3C[C@H](OS([O-])(=O)=O)[C@H]4[C@@H](O)[C@H](OS([O-])(=O)=O)[C@H](C[C@]4(C)C3=CC[C@]12C)OS([O-])(=O)=O

InChIKey

InChIKey=YBDMUTVENCIYLQ-HBXCSJRJSA-K

Formula

C30H43Na3O16S3

Mass

824.81

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Hydroxysteroids

Intermediate Tree Nodes

Not available

Direct Parent

Hydroxysteroids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Sulfated steroid skeleton - 14-alpha-methylsteroid - Hydroxysteroid - 4-hydroxysteroid - Terpene lactone - Pinguisane sesquiterpenoid - Sesquiterpenoid - Cyclitol or derivatives - Sulfuric acid ester - Alkyl sulfate - 2-furanone - Sulfate-ester - Sulfuric acid monoester - Organic sulfuric acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Cyclic alcohol - Dihydrofuran - Carboxylic acid ester - Hemiacetal - Lactone - Secondary alcohol - Monocarboxylic acid or derivatives - Organic alkali metal salt - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organic sodium salt - Hydrocarbon derivative - Alcohol - Carbonyl group - Organooxygen compound - Organic oxide - Organic salt - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hydroxysteroids. These are compounds containing an steroid backbone, with at least one hydrogen substituted by a hydroxyl group.

External Descriptors

Not available

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