Structure Information
Structure

Compound Identification

SMILES

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OCCCCCCNC[C@H]1O[C@H](S)[C@@H](O)[C@@H](O)[C@@H]1O

InChIKey

InChIKey=NRQRCAUMBCSSMX-LFMDNDDKSA-N

Formula

C39H69NO5S

Mass

664.04

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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 heteropolycyclic compounds

Substituents

Cholesterol - Delta-5-steroid - Monosaccharide - Oxane - 1,2-diol - Secondary alcohol - Organoheterocyclic compound - Polyol - Oxacycle - Secondary amine - Alkylthiol - Dialkyl ether - Secondary aliphatic amine - Ether - Alcohol - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organosulfur compound - Aliphatic heteropolycyclic 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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