Compound Identification
SMILES
C[C@H]1CC2=C([C@@H](O)C[C@@]3(C)[C@H]2CC[C@]3(OC(=O)C2=CC=CC=C2)C(=O)CO)[C@@]2(C)C=CC(=O)C=C12
InChIKey
InChIKey=UXCXTRXTUNZSMV-DKVKKGBGSA-N
Formula
C29H32O6
Mass
476.569
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Steroid esters 20-oxosteroids Androgens and derivatives 3-oxo delta-1,4-steroids 11-beta-hydroxysteroids Delta-1,4-steroids Benzoic acid esters Benzoyl derivatives Alpha-hydroxy ketones Secondary alcohols Cyclic ketones Carboxylic acid esters Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
21-hydroxysteroid - 20-oxosteroid - Steroid ester - Androgen-skeleton - Androstane-skeleton - 11-hydroxysteroid - 11-beta-hydroxysteroid - 3-oxosteroid - Oxosteroid - 3-oxo-delta-1,4-steroid - Delta-1,4-steroid - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Benzenoid - Monocyclic benzene moiety - Alpha-hydroxy ketone - Cyclic ketone - Secondary alcohol - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Alcohol - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic homopolycyclic 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