Compound Identification
SMILES
CCC(C)C(=O)OC[C@]1(C)CC[C@H](O)[C@@]2(C)[C@H]1CCC1=C2CC[C@@](C)(C=C)[C@H]1OC(C)=O
InChIKey
InChIKey=QKFZOHYVWBVZEU-MJSBBHSZSA-N
Formula
C27H42O5
Mass
446.628
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
Oxosteroids
- Level 5 16-oxosteroids
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Subclass
Oxosteroids
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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
Oxosteroids
Intermediate Tree Nodes
Not available
Direct Parent
16-oxosteroids
Alternative Parents
1-hydroxysteroids Diterpenoids Hydrophenanthrenes Fatty acid esters Dicarboxylic acids and derivatives Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Diterpenoid - Pimarane diterpenoid - 1-hydroxysteroid - 16-oxosteroid - Hydroxysteroid - Phenanthrene - Hydrophenanthrene - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Organooxygen compound - Aliphatic homopolycyclic 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