Structure Information
Structure

Compound Identification

SMILES

CC#CCC#CCOC(CCOCCOCCOCCOCCNC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C)OC(=O)CC(O)=O

InChIKey

InChIKey=PLKBRKFCGBPKDY-UHFFFAOYSA-N

Formula

C49H77NO11

Mass

856.151

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Cholesterol - Delta-5-steroid - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Carbamic acid ester - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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

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