Compound Identification
SMILES
[H]C1=C([H])C2=CC3=C(C(OC)=C2C(=O)OC([H])(C)CCCC(=O)CCC1)C([H])(CC(=O)O3)C1=CC=C(C=C1)C(C)C
InChIKey
InChIKey=CUINMXKTEOKVJJ-UHFFFAOYSA-N
Formula
C31H36O6
Mass
504.623
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Macrolides and analogues
- Subclass Zearalenones
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Class
Macrolides and analogues
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Macrolides and analogues
Subclass
Zearalenones
Intermediate Tree Nodes
Not available
Direct Parent
Zearalenones
Alternative Parents
Terpene lactones Neoflavans 3,4-dihydrocoumarins 1-benzopyrans Aromatic monoterpenoids Phenylpropanes Cumenes Anisoles Alkyl aryl ethers Lactones Cyclic ketones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Zearalenone-skeleton - Neoflavan - Neoflavonoid skeleton - Terpene lactone - 3,4-dihydrocoumarin - P-cymene - Aromatic monoterpenoid - Chromane - Benzopyran - Monoterpenoid - 1-benzopyran - Phenylpropane - Cumene - Phenol ether - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Cyclic ketone - Carboxylic acid ester - Lactone - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Ether - Organoheterocyclic compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as zearalenones. These are macrolides which contains a fourteen-member lactone fused to 1,3-dihydroxybenzene.
External Descriptors
Not available