Structure Information
Structure

Compound Identification

SMILES

CC(C)=C[C@H]1C[C@](C)(O)C2C3CCC4[C@@]5(C)CCC[C@](C)(O[C@H]6OC[C@H](O)[C@H](OC7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@H]6C[C@H](CO)[C@@H](O)[C@@H]6O)C5CC[C@@]4(C)[C@@]33CO[C@@]2(C3)O1

InChIKey

InChIKey=XRFBJUCOZPQFJH-TZBBDDFWSA-N

Formula

C46H74O16

Mass

883.082

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Steroids and steroid derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Steroid - Sesquiterpenoid - Naphthopyran - Disaccharide - Glycosyl compound - O-glycosyl compound - Naphthalene - Ketal - Cyclitol or derivatives - Cyclopentanol - Oxane - Pyran - Tetrahydrofuran - Cyclic alcohol - Tertiary alcohol - Secondary alcohol - Polyol - Organoheterocyclic compound - Oxacycle - Ether - Dialkyl ether - Acetal - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Primary alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroids and steroid derivatives. These are compounds based on the cyclopenta[a]phenanthrene carbon skeleton, partially or completely hydrogenated; there are usually methyl groups at C-10 and C-13, and often an alkyl group at C-17. By extension, one or more bond scissions, ring expansions and/or ring contractions of the skeleton may have occurred.

External Descriptors

Not available

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