Compound Identification
SMILES
N.CC(C)CCC[C@@H](C)C1CCC2C3CCC4C[C@@H](CCC=C(C5=CC(C(O)=O)=C(O)C(F)=C5)C5=CC(C(O)=O)=C(O)C(F)=C5)CC[C@]4(C)C3CC[C@]12C
InChIKey
InChIKey=DEJKBEVVVZZUPM-SGAANVMNSA-N
Formula
C45H63F2NO6
Mass
751.997
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Cholestane steroids
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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
Cholestane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Cholestane steroids
Alternative Parents
Diphenylmethanes Salicylic acids 3-halobenzoic acids Halobenzoic acids Benzoic acids Styrenes Benzoyl derivatives O-fluorophenols Fluorobenzenes Aryl fluorides Dicarboxylic acids and derivatives Vinylogous acids Carboxylic acids Hydrocarbon derivatives Organic nitrogen compounds Organic oxides Organofluorides Organooxygen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cholestane-skeleton - Diphenylmethane - Salicylic acid or derivatives - Salicylic acid - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid - Halobenzoic acid - Hydroxybenzoic acid - Benzoic acid - Benzoic acid or derivatives - 2-fluorophenol - Benzoyl - Styrene - 2-halophenol - Phenol - Fluorobenzene - Halobenzene - Aryl fluoride - Dicarboxylic acid or derivatives - Benzenoid - Monocyclic benzene moiety - Aryl halide - Vinylogous acid - Carboxylic acid derivative - Carboxylic acid - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cholestane steroids. These are steroids with a structure containing the 27-carbon cholestane skeleton.
External Descriptors
Not available