Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H](CCC(=O)C(C)C)[C@H](COS(=O)(=O)C3=CC=C(C)C=C3)CC[C@@H]12

InChIKey

InChIKey=QLLPGVUNBJQUDO-VALHTMQASA-N

Formula

C28H42O6S

Mass

506.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesquiterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Sesquiterpenoids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Sesquiterpenoid - Megastigmane sesquiterpenoid - Benzenesulfonate ester - P-methylbenzenesulfonate - Tosyl compound - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Toluene - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Methyl ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.

External Descriptors

Not available

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