Compound Identification
SMILES
C[C@H](CCC1=NC(C#N)=C(N)O1)[C@H]1CC[C@H]2[C@@H]3CCC4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@@H](O)[C@]12C
InChIKey
InChIKey=PEOWSKIBKZKDAY-HEIVMAJXSA-N
Formula
C27H41N3O3
Mass
455.643
Taxonomic Classification
Taxonomy Tree
-
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
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Level 5
3-hydroxysteroids
- Level 6 3-beta-hydroxysteroids
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Level 5
3-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
3-hydroxysteroids
Direct Parent
3-beta-hydroxysteroids
Alternative Parents
12-hydroxysteroids 2,4,5-trisubstituted oxazoles Heteroaromatic compounds Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Nitriles Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
12-hydroxysteroid - 3-beta-hydroxysteroid - 2,4,5-trisubstituted 1,3-oxazole - Azole - Cyclic alcohol - Oxazole - Heteroaromatic compound - Secondary alcohol - Organoheterocyclic compound - Nitrile - Carbonitrile - Azacycle - Oxacycle - Organopnictogen compound - Primary amine - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-beta-hydroxysteroids. These are steroids carrying a beta-hydroxyl group at the 3-position of the steroid backbone.
External Descriptors
Not available