Structure Information
Structure

Compound Identification

SMILES

CO[C@H]1C[C@H](O[C@H]2C(OC3C#C\C=C/C#C[C@]4(O)CC(=O)C(NC(=O)OC)=C3\C4=C/CSSSC)O[C@H](C)[C@@](SC)(C(CO)O[C@H]3C[C@H](O)[C@H](SC)[C@@H](C)O3)[C@@H]2O)OC[C@@H]1NC(C)C

InChIKey

InChIKey=PYODOXNMJUJHHR-YMZSJPQTSA-N

Formula

C43H62N2O14S5

Mass

991.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cyclohexenone - Monosaccharide - Oxane - Ynone - Methylcarbamate - Organic trisulfide - Tertiary alcohol - Carbamic acid ester - Secondary alcohol - Acetal - Dialkyl ether - Secondary aliphatic amine - Ether - Secondary amine - Oxacycle - Thioether - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Organonitrogen compound - Organosulfur compound - Organic oxide - Primary alcohol - Hydrocarbon derivative - Amine - Alcohol - Aldehyde - Organic nitrogen compound - Organopnictogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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