Compound Identification
SMILES
COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(=O)OC[C@@H](O)CO
InChIKey
InChIKey=AGANHPVGHKGEKN-HQAMWZJRSA-N
Formula
C20H26O8
Mass
394.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isocoumarans
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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
1-monoacylglycerols Anisoles Alkyl aryl ethers Phenols Fatty acid esters Vinylogous acids 1,2-diols Secondary alcohols Carboxylic acid esters Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalide - Monoacylglycerol - 1-acyl-sn-glycerol - Phenol ether - Anisole - Monoradylglycerol - Fatty acid ester - Alkyl aryl ether - Phenol - Glycerolipid - Fatty acyl - Benzenoid - Vinylogous acid - Carboxylic acid ester - 1,2-diol - Secondary alcohol - Lactone - Oxacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Organic oxygen compound - Primary alcohol - Alcohol - Organooxygen compound - Hydrocarbon derivative - 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