Structure Information
Structure

Compound Identification

SMILES

CC1=C(C(=O)OC2CC3(C)C4CC(C)(C)CC4C=C(C=O)C23O)C(O)=CC(O)=C1Cl

InChIKey

InChIKey=UHFQTECWVLYLBG-UHFFFAOYSA-N

Formula

C23H27ClO6

Mass

434.91

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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

Illudanes and illudins

Direct Parent

Melleolides and analogues

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Melleolide-skeleton - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Benzoate ester - Salicylic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - 4-halophenol - 2-halophenol - M-cresol - 2-chlorophenol - 4-chlorophenol - Resorcinol - Toluene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Chlorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Tertiary alcohol - Vinylogous acid - Cyclobutanol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Aldehyde - Carbonyl group - Alcohol - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as melleolides and analogues. These are compounds with a structure characterized by the presence of a 2-hydroxy-4-methoxy-6-methylbenzoic acid derivative linked to a 3,6,6,7b-tetramethyl-cyclobuta[e]indene moiety.

External Descriptors

Not available

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