Compound Identification
SMILES
[Ca++].CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H]([O-])CC[C@]4(C)[C@H]3CC[C@]12C.CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H]([O-])CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey
InChIKey=BRVFSOMOALBKKM-LOUIJUBOSA-N
Formula
C54H90CaO2
Mass
811.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Cholestane steroids
- Level 5 Cholesterols and derivatives
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Subclass
Cholestane steroids
-
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
Cholestane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Cholesterols and derivatives
Alternative Parents
Delta-5-steroids Organic calcium salts Organic zwitterions Organic oxides Hydrocarbon derivatives Alkoxides
Molecular Framework
Not available
Substituents
Cholesterol - Delta-5-steroid - Organic calcium salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Alkoxide - Organooxygen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cholesterols and derivatives. These are compounds containing a 3-hydroxylated cholestane core.
External Descriptors
Not available