Compound Identification
SMILES
CC1(C)O[C@@H]2CC3C4CCC5=CC6=C(CC5(C)C4CCC3(C)[C@@]2(O1)C(=O)CO)C=NN6C1=CC=C(F)C=C1
InChIKey
InChIKey=ZKQWOXNCVIOFMH-XMMCNQKCSA-N
Formula
C31H37FN2O4
Mass
520.645
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Hydroxysteroids
- Level 5 21-hydroxysteroids
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Subclass
Hydroxysteroids
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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
Hydroxysteroids
Intermediate Tree Nodes
Not available
Direct Parent
21-hydroxysteroids
Alternative Parents
Pregnane steroids 20-oxosteroids Phenylpyrazoles Fluorobenzenes Ketals Aryl fluorides 1,3-dioxolanes Alpha-hydroxy ketones Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organofluorides Primary alcohols Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
21-hydroxysteroid - 20-oxosteroid - Pregnane-skeleton - Oxosteroid - Phenylpyrazole - Ketal - Halobenzene - Fluorobenzene - Benzenoid - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Alpha-hydroxy ketone - Meta-dioxolane - Pyrazole - Heteroaromatic compound - Azole - Ketone - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Primary alcohol - Organic oxygen compound - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 21-hydroxysteroids. These are steroids carrying a hydroxyl group at the 21-position of the steroid backbone.
External Descriptors
Not available