Compound Identification
SMILES
OCC1(O)OC(COC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O
InChIKey
InChIKey=WNXKQZHTEHIGBQ-UHFFFAOYSA-N
Formula
C13H16O10
Mass
332.261
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
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Level 6
Gallic acid and derivatives
- Level 7 Galloyl esters
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Level 6
Gallic acid and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Hydroxybenzoic acid derivatives - Gallic acid and derivatives
Direct Parent
Galloyl esters
Alternative Parents
p-Hydroxybenzoic acid alkyl esters m-Hydroxybenzoic acid esters C-glycosyl compounds Pentoses Pyrogallols and derivatives Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Oxolanes Secondary alcohols 1,2-diols Hemiacetals Carboxylic acid esters Oxacyclic compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Galloyl ester - Glycosyl compound - P-hydroxybenzoic acid alkyl ester - C-glycosyl compound - P-hydroxybenzoic acid ester - M-hydroxybenzoic acid ester - Benzoate ester - Pentose monosaccharide - Benzenetriol - Pyrogallol derivative - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Monosaccharide - Oxolane - Hemiacetal - Secondary alcohol - Carboxylic acid ester - 1,2-diol - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Polyol - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organic oxide - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as galloyl esters. These are organic compounds that contain an ester derivative of 3,4,5-trihydroxybenzoic acid.
External Descriptors
Not available