Compound Identification
SMILES
O=C1OC(=O)C=C1.CCC(CO)(CO)CO.OC(=O)C1=CC=CC=C1.CCCCC(CC)C(O)=O.O=C1OC(=O)C2=CC=CC=C12
InChIKey
InChIKey=FEEGJPPUKRFCGD-UHFFFAOYSA-N
Formula
C33H42O13
Mass
646.686
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzofurans
-
Subclass
Benzofuranones
- Level 5 Phthalic anhydrides
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Subclass
Benzofuranones
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Class
Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Benzofuranones
Intermediate Tree Nodes
Not available
Direct Parent
Phthalic anhydrides
Alternative Parents
Isobenzofuranones Benzoic acids Medium-chain fatty acids Benzoyl derivatives Branched fatty acids Dicarboxylic acids and derivatives Dihydrofurans Carboxylic acid anhydrides Oxacyclic compounds Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Phthalic anhydride - Phthalic_anhydride - Isobenzofuranone - Isocoumaran - Benzoic acid - Benzoic acid or derivatives - Medium-chain fatty acid - Benzoyl - Branched fatty acid - Fatty acyl - Fatty acid - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Dihydrofuran - Carboxylic acid anhydride - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalic anhydrides. These are compounds containing a phthalic anhydride moiety (or a derivative thereof), which consists of a benzene fused to a furan-1,3-dione.
External Descriptors
Not available