Compound Identification
SMILES
CNCCOc1cc(O)c2c(CCCC(=O)C(=O)C(=O)CC[C@@H](C)[C@H](C)OC2=O)c1
InChIKey
InChIKey=MYCCFXFOIOULJE-KGLIPLIRSA-N
Formula
C22H29NO7
Mass
419.474
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
Phenol ethers Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Lactones Cyclic ketones Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Dialkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Zearalenone-skeleton - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Vinylogous acid - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Oxacycle - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen 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