Compound Identification
SMILES
CC(CCC=C(C1=CC(C(O)=O)=C(O)C(Cl)=C1)C1=CC(C(O)=O)=C(O)C(Cl)=C1)C1CCC2[C@@H]3CC[C@@H]4CC(F)(F)CC[C@]4(C)C3CC[C@]12C
InChIKey
InChIKey=DZYBUBMYCKMAMW-OXVCZTGGSA-N
Formula
C39H46Cl2F2O6
Mass
719.69
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
Halogenated steroids Diphenylmethanes Salicylic acids 3-halobenzoic acids Halobenzoic acids Benzoic acids Styrenes Benzoyl derivatives O-chlorophenols Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives Vinylogous acids Carboxylic acids Organooxygen compounds Organic oxides Organochlorides Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cholestane-skeleton - 3-halo-steroid - Halo-steroid - Diphenylmethane - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Hydroxybenzoic acid - Salicylic acid - Salicylic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Benzoyl - 2-halophenol - Styrene - 2-chlorophenol - Phenol - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Vinylogous acid - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Alkyl fluoride - Organic oxide - Organic oxygen compound - Alkyl halide - Organochloride - Organofluoride - Organooxygen compound - Hydrocarbon derivative - 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