Compound Identification
SMILES
CC(C)[C@@H](C)CC[C@@H](C)[C@H]1C[C@@H](O)[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@]4(O)C[C@@H](O)CC[C@@]4(C)[C@H]3CC[C@@]12C
InChIKey
InChIKey=MFEVBBHCDHXRAO-SBMRDKATSA-N
Formula
C28H50O5
Mass
466.703
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Ergostane steroids
- Level 5 Ergosterols and derivatives
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Subclass
Ergostane steroids
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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
Ergostane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Ergosterols and derivatives
Alternative Parents
7-alpha-hydroxysteroids 6-hydroxysteroids 3-beta-hydroxysteroids Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Polyols Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Ergosterol-skeleton - 7-hydroxysteroid - 7-alpha-hydroxysteroid - 3-beta-hydroxysteroid - Hydroxysteroid - 5-hydroxysteroid - 15-hydroxysteroid - 6-hydroxysteroid - 3-hydroxysteroid - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Polyol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as ergosterols and derivatives. These are steroids containing ergosta-5,7,22-trien-3beta-ol or a derivative thereof, which is based on the 3beta-hydroxylated ergostane skeleton.
External Descriptors
Not available