Compound Identification
SMILES
COC(=O)C1=CC=C(COC2=CC(O)=C3C(=C2)C=CCCCC(=O)CCCC(C)OC3=O)O1
InChIKey
InChIKey=ZKYHKTULGJJUMU-UHFFFAOYSA-N
Formula
C25H28O8
Mass
456.491
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
Furoic acid esters Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Dicarboxylic acids and derivatives Vinylogous acids Methyl esters Heteroaromatic compounds Lactones Cyclic ketones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Zearalenone-skeleton - Furoic acid ester - Furoic acid or derivatives - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Dicarboxylic acid or derivatives - Benzenoid - Furan - Methyl ester - Heteroaromatic compound - Vinylogous acid - Cyclic ketone - Lactone - Ketone - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Organic oxide - Carbonyl group - 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