Compound Identification
SMILES
COC(=O)CC\C(C)=C\CC1=C(O)C2=C(COC2=O)C(C)=C1OC(=O)C1=CC=NC=C1
InChIKey
InChIKey=PZFGCEGOWFFDRK-YIXHJXPBSA-N
Formula
C23H23NO7
Mass
425.437
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isocoumarans
-
Subclass
Isobenzofuranones
- Level 5 Phthalides
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Subclass
Isobenzofuranones
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Class
Isocoumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isocoumarans
Subclass
Isobenzofuranones
Intermediate Tree Nodes
Not available
Direct Parent
Phthalides
Alternative Parents
Phenol esters Pyridinecarboxylic acids Phenols Fatty acid methyl esters Vinylogous acids Methyl esters Heteroaromatic compounds Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - Phthalide - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Fatty acid ester - Phenol - Fatty acid methyl ester - Pyridine - Benzenoid - Fatty acyl - Methyl ester - Heteroaromatic compound - Vinylogous acid - Carboxylic acid ester - Lactone - Azacycle - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalides. These are compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,.
External Descriptors
Not available