Structure Information
Structure

Compound Identification

SMILES

[H]C1(CC2(C)C1=C(CO)C([H])(O)C1([H])CC(C)(C)CC21[H])OC(=O)C1=C(O)C(O)=C(O)C=C1C

InChIKey

InChIKey=PTVABGVMGJFKGM-UHFFFAOYSA-N

Formula

C23H30O7

Mass

418.486

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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 - M-hydroxybenzoic acid ester - P-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Benzoate ester - Salicylic acid or derivatives - Benzenetriol - Benzoic acid or derivatives - Pyrogallol derivative - M-cresol - Benzoyl - P-cresol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Toluene - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Polyol - Alcohol - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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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