Structure Information
Structure

Compound Identification

SMILES

C[C@@H]([C@H](C)C(C)(C)OC(C)=O)[C@@H](OC(C)=O)[C@]1(C)O[C@]11[C@@H](O)C[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12COC(C)=O

InChIKey

InChIKey=XOJRUWKKDXDTAW-VZSSOFQGSA-N

Formula

C35H54O9

Mass

618.808

Export to:

JSON SDF CSV

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 - Steroid ester - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 3-oxo-5-alpha-steroid - 16-hydroxysteroid - 16-beta-hydroxysteroid - Tricarboxylic acid or derivatives - Cyclic alcohol - Cyclic ketone - Secondary alcohol - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Oxirane - Ether - Organic oxygen compound - Carbonyl group - Alcohol - Organic oxide - Hydrocarbon derivative - Organooxygen compound - 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

Previous Back Next