Compound Identification
SMILES
CCC1(CC[C@]2(C)C(C)C(=O)C=C3[C@@]2(C)CC[C@H]2C(C)(C)C(=O)[C@@]4(O[C@@H]4[C@]32C)C#N)CCC(C)(C)CC1
InChIKey
InChIKey=HUMMHPRMXVZDPL-BFZZTDQUSA-N
Formula
C33H49NO3
Mass
507.759
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
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Level 5
3-oxosteroids
- Level 6 1,2-epoxy-3-oxosteroids
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Level 5
3-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
3-oxosteroids - 1,2-epoxy-3-oxosteroids
Direct Parent
1-alpha,2-epoxy-3-oxo-5-alpha-steroids
Alternative Parents
3-oxo-5-alpha-steroids Oxepanes Cyclohexenones Oxacyclic compounds Nitriles Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
1-alpha,2-epoxy-3-oxo-5-alpha-steroid - 3-oxo-5-alpha-steroid - Oxepane - Cyclohexenone - Ketone - Cyclic ketone - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Oxirane - Dialkyl ether - Carbonyl group - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-alpha,2-epoxy-3-oxo-5-alpha-steroids. These are 3-oxo-5-alpha-steroids sharing the carbon atoms C1 and C2 wit an epoxide ring to form a 1-alpha,2-epoxy moiety.
External Descriptors
Not available