Compound Identification
SMILES
CC(C)CCC[C@H](C)[C@@H]1CC=C2[C@@H]3C[C@@H](O)[C@@H]4[C@@H](CCCC(=O)OC(=O)C=C)[C@@H](O)CC[C@@]4(C)[C@H]3CC[C@@]12C
InChIKey
InChIKey=DWNPUOOVVWZXRN-UULAKNPHSA-N
Formula
C34H54O5
Mass
542.801
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Cholestane steroids
- Level 5 Cholesterols and derivatives
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Subclass
Cholestane 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
Cholestane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Cholesterols and derivatives
Alternative Parents
7-alpha-hydroxysteroids 6-hydroxysteroids 3-beta-hydroxysteroids Dicarboxylic acids and derivatives Acrylic acid esters Carboxylic acid anhydrides Secondary alcohols Cyclic alcohols and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Cholesterol-skeleton - 3-hydroxysteroid - 6-hydroxysteroid - Hydroxysteroid - 3-beta-hydroxysteroid - 7-alpha-hydroxysteroid - 7-hydroxysteroid - Dicarboxylic acid or derivatives - Acrylic acid ester - Cyclic alcohol - Carboxylic acid anhydride - Acrylic acid or derivatives - Secondary alcohol - Carboxylic acid derivative - Carbonyl group - Organooxygen compound - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cholesterols and derivatives. These are compounds containing a 3-hydroxylated cholestane core.
External Descriptors
Not available