Compound Identification
SMILES
[H]C1=C([H])C2=CC3=C(C(CC(=O)O3)C3=C(OC(C)C)C(OC)=CC=C3)C(O)=C2C(=O)OC(C)CCCC(=O)CCC1
InChIKey
InChIKey=RJVDYZVAPOVBPK-UHFFFAOYSA-N
Formula
C31H36O8
Mass
536.621
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Macrolides and analogues
- Subclass Zearalenones
-
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 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Vinylogous acids Lactones Carboxylic acid esters Cyclic ketones Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Zearalenone-skeleton - Neoflavan - Neoflavonoid skeleton - 3,4-dihydrocoumarin - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Ketone - Carboxylic acid ester - Lactone - Cyclic ketone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxide - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen 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