Compound Identification
SMILES
COc1cc(O)c(C(=O)O[C@@H]2C[C@]3(C)[C@H]4CC(C)(C)C[C@H]4[C@H](O)[C@@H](CO)[C@]23O)c(C)c1Cl
InChIKey
InChIKey=CDZOUKIQVOWDFN-DRCOUIQZSA-N
Formula
C24H33ClO7
Mass
468.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Sesquiterpenoids
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Level 5
Illudanes and illudins
- Level 6 Melleolides and analogues
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Level 5
Illudanes and illudins
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Subclass
Sesquiterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
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
Diterpenoids o-Hydroxybenzoic acid esters P-methoxybenzoic acids and derivatives 3-halobenzoic acids and derivatives Methoxyphenols Salicylic acid and derivatives Anisoles Benzoyl derivatives Meta cresols Methoxybenzenes P-chlorophenols Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Toluenes Chlorobenzenes Aryl chlorides Tertiary alcohols Vinylogous acids Cyclic alcohols and derivatives Carboxylic acid esters Secondary alcohols Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Primary alcohols
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Melleolide-skeleton - Diterpenoid - 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 - Benzoyl - Phenoxy compound - 4-chlorophenol - Phenol ether - Anisole - Methoxybenzene - 4-halophenol - M-cresol - Chlorobenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Toluene - Phenol - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Tertiary alcohol - Vinylogous acid - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Cyclobutanol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - 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