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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Vitamin D and derivatives
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
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
Triterpenoids Ergostane steroids Thromboxanes 7-hydroxysteroids 6-hydroxysteroids Oxanes Sulfonyls Organosulfonic acids and derivatives Organic sulfuric acids and derivatives Secondary alcohols Cyclic alcohols and derivatives Polyols Oxacyclic compounds Organic superoxides Dialkyl ethers Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic anions
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