Compound Identification
SMILES
CC1=C2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCC2=CC(OC(=O)C2=CC=CC=C2)=C1)OC(=O)COC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl
InChIKey
InChIKey=KOBFCWJNUHTTEY-RVAPVIFVSA-N
Formula
C42H49Cl2NO6
Mass
734.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
- Subclass Steroid esters
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Class
Steroids and steroid derivatives
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Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Steroid esters
Intermediate Tree Nodes
Not available
Direct Parent
Steroid esters
Alternative Parents
Estrane steroids Phenanthrenes and derivatives Tetralins Phenol esters Benzoic acid esters Aniline and substituted anilines Nitrogen mustard compounds Benzoyl derivatives Dialkylarylamines Dicarboxylic acids and derivatives Carboxylic acid esters Amino acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Alkyl chlorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Steroid ester - Estrane-skeleton - Phenanthrene - Benzoate ester - Phenol ester - Tetralin - Benzoic acid or derivatives - Benzoyl - Nitrogen mustard - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Alkyl chloride - Organic oxygen compound - Organic nitrogen compound - Organochloride - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as steroid esters. These are compounds containing a steroid moiety which bears a carboxylic acid ester group.
External Descriptors
Not available