Compound Identification
SMILES
COP([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=DPNNTRMDXNHRRU-CLBZNQKCSA-L
Formula
C29H49O12PS
Mass
652.73
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 Alkyl phosphates Sulfonyls Organosulfonic acids and derivatives Secondary alcohols Cyclic alcohols and derivatives Polyols Oxacyclic compounds Organic superoxides Dialkyl ethers 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 - Alkyl phosphate - Phosphoric acid ester - Oxane - Organic phosphoric acid derivative - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Cyclic alcohol - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Polyol - Organic superoxide - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen 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