Compound Identification
SMILES
CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](CCCC(C5=CC(Cl)=C(O)C(=C5)C(=O)N[C@@H](CCC(O)=O)C(O)=O)C5=CC(Cl)=C(O)C(=C5)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey
InChIKey=GIPAVLQUDOLMRW-WPRTWXJXSA-N
Formula
C55H76Cl2N2O12
Mass
1028.12
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
Glutamic acid and derivatives Tetracarboxylic acids and derivatives N-acyl-alpha amino acids Hippuric acids Diphenylmethanes Salicylamides 3-halobenzoic acids and derivatives Benzoyl derivatives O-chlorophenols Chlorobenzenes Aryl chlorides Vinylogous acids Secondary carboxylic acid amides Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cholestane-skeleton - Glutamic acid or derivatives - Diphenylmethane - Hippuric acid or derivatives - Hippuric acid - Tetracarboxylic acid or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Salicylic acid or derivatives - Salicylamide - Benzamide - Benzoic acid or derivatives - Benzoyl - 2-halophenol - 2-chlorophenol - Phenol - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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