Structure Information
Structure

Compound Identification

SMILES

COC1=C(Cl)C(C)=C(C(=O)O[C@@H]2C[C@]3(C)[C@H]4CC(C)(C)C[C@H]4[C@H](O)C(C=O)=C23)C(O)=C1

InChIKey

InChIKey=KWJJPEZBNLGOFB-RNNQDMPLSA-N

Formula

C24H29ClO6

Mass

448.94

Export to:

JSON SDF CSV

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 - O-hydroxybenzoic acid ester - P-methoxybenzoic acid or derivatives - Benzoate ester - Methoxyphenol - Salicylic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - 4-halophenol - M-cresol - 4-chlorophenol - Phenol ether - Methoxybenzene - Toluene - Phenol - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Alkyl aryl ether - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Vinylogous acid - Secondary alcohol - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organooxygen compound - Aldehyde - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organic oxide - Organohalogen compound - Organochloride - Carbonyl group - 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

Previous Back Next