Structure Information
Structure

Compound Identification

SMILES

COC[C@@H](O)[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3CC4=C5[C@@H](O)[C@@H](O)[C@H]6C[C@@H](O)CC[C@@]6(C)[C@H]5CC[C@@]4(C)[C@H]3[C@H](C)CCC(=C)C(C)C)O[C@H]2[C@H](O)COC)[C@H](O)[C@H]1O

InChIKey

InChIKey=FUWIMIQPBOPYNH-GKMFNVFMSA-N

Formula

C42H70O14

Mass

799.008

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Ergosterol-skeleton - Steroidal glycoside - 7-hydroxysteroid - 7-alpha-hydroxysteroid - 3-beta-hydroxysteroid - Hydroxysteroid - 6-hydroxysteroid - 3-hydroxysteroid - O-glycosyl compound - Glycosyl compound - Disaccharide - Tetrahydrofuran - Cyclic alcohol - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Polyol - Ether - Dialkyl ether - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic heteropolycyclic 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

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