Structure Information
Structure

Compound Identification

SMILES

[H][C@]12C[C@@]([H])(C)[C@@]3([H])[C@@]4(C)CC[C@@]56C[C@@]55CC[C@]([H])(O[C@]7([H])OC[C@@]([H])(O)[C@]([H])(O)[C@@]7([H])O)C(C)(C)[C@@]5([H])C[C@]([H])(O)[C@]6([H])[C@]4(C)C[C@@]3(O1)O[C@]2([H])C(C)(C)O

InChIKey

InChIKey=MKQCLTNEQAMHGK-FTHJTPBPSA-N

Formula

C35H56O9

Mass

620.824

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroidal glycosides

Intermediate Tree Nodes

Steroidal saponins

Direct Parent

Cucurbitacin glycosides

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cucurbitacin glycoside skeleton - Cycloartanol-skeleton - 9b,19-cyclo-lanostane-skeleton - Cycloartane-skeleton - Triterpenoid - 7-hydroxysteroid - Hydroxysteroid - Glycosyl compound - O-glycosyl compound - Ketal - Oxepane - Oxane - Monosaccharide - Tertiary alcohol - Meta-dioxolane - Cyclic alcohol - Secondary alcohol - Acetal - Organoheterocyclic compound - Oxacycle - Polyol - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cucurbitacin glycosides. These are polycyclic compounds containing a carbohydrate derivative glycosidically linked to a curcubitane nucleus.

External Descriptors

Not available

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