Compound Identification
SMILES
CC12CCC3OC(COC4=CC=CC=C4)OCC3(C)C1CCC(O)C2CC(=O)N1CCCC1CO
InChIKey
InChIKey=YEJALYMXLKUAQS-UHFFFAOYSA-N
Formula
C28H41NO6
Mass
487.637
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Oxosteroids
- Level 5 16-oxosteroids
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Subclass
Oxosteroids
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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
Oxosteroids
Intermediate Tree Nodes
Not available
Direct Parent
16-oxosteroids
Alternative Parents
Phenoxy compounds Phenol ethers N-acylpyrrolidines Alkyl aryl ethers 1,3-dioxanes Tertiary carboxylic acid amides Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Azacyclic compounds Acetals Primary alcohols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
16-oxosteroid - Phenoxy compound - Phenol ether - N-acylpyrrolidine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Meta-dioxane - Tertiary carboxylic acid amide - Pyrrolidine - Cyclic alcohol - Secondary alcohol - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 16-oxosteroids. These are steroid derivatives carrying a C=O group at the 16-position of the steroid skeleton.
External Descriptors
Not available