Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCCC(=O)OCC1=C[C@H]2C3C(C)(C)C3(OC(C)=O)[C@H](OC(=O)CCCCCCCCCCCCC)[C@@H](C)[C@]2(O)[C@@H]2C=C(C)C(=O)[C@]2(O)C1

InChIKey

InChIKey=SCKGCFZOPIYMSK-TXSUOPFHSA-N

Formula

C50H82O9

Mass

827.197

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Tigliane and ingenane diterpenoids

Direct Parent

Phorbol esters

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Phorbol ester - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acyl - Cyclic alcohol - Tertiary alcohol - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as phorbol esters. These are tigliane diterpenoids which are esters of phorbol.

External Descriptors

Not available

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