Structure Information
Structure

Compound Identification

SMILES

CNS(=O)(=O)O[C@@H]1[C@H]2O[C@H](C[C@@H](C)[C@@H]2[C@@]2(C)CC[C@H]3[C@H]([C@H]12)[C@@H](O)[C@@H](O)[C@H]1[C@@H](O)[C@@H](CC[C@]31C)S(=O)(=O)O[O-])[C@@H](C)C(C)C

InChIKey

InChIKey=DOZLGGODPAGQKE-CLBZNQKCSA-M

Formula

C29H50NO11S2

Mass

652.84

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Vitamin D and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Vitamin D and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Triterpenoid - Ergostane-skeleton - Thromboxane - Eicosanoid - 7-hydroxysteroid - Hydroxysteroid - 6-hydroxysteroid - 4-hydroxysteroid - Fatty acyl - Oxane - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic sulfuric acid or derivatives - Cyclic alcohol - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Polyol - Organic superoxide - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Organic anion - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as vitamin d and derivatives. These are compounds containing a secosteroid backbone, usually secoergostane or secocholestane.

External Descriptors

Not available

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