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(OC)=C(OC)C(OC)=C1
InChIKey
InChIKey=QHYMPLXPJUYIPS-UHFFFAOYSA-N
Formula
C31H36O9
Mass
552.62
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
Neoflavans 3,4-dihydrocoumarins 1-benzopyrans Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Lactones Cyclic ketones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Zearalenone-skeleton - Neoflavan - Neoflavonoid skeleton - 3,4-dihydrocoumarin - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Lactone - Ketone - Carboxylic acid ester - Cyclic ketone - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - 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