Compound Identification
SMILES
CO[C@H]1O[C@@]2(C)CC(=O)[C@H]3C[C@]2(O[C@@H]2O[C@H](OC(=O)C4=CC(O)=C(O)C(O)=C4)[C@@H](O)[C@H](O)[C@H]2O)[C@]13COC(=O)C1=CC=CC=C1
InChIKey
InChIKey=OPJDRRWEWCOFIH-DHTKUQSKSA-N
Formula
C30H32O15
Mass
632.571
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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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
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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 O-glycosyl compounds Aromatic monoterpenoids Bicyclic monoterpenoids Pyrogallols and derivatives Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Oxepanes Monosaccharides Dicarboxylic acids and derivatives Oxanes Oxolanes Ketones Carboxylic acid esters Secondary alcohols Acetals Polyols Oxacyclic compounds Hydrocarbon derivatives Aldehydes Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Galloyl ester - P-hydroxybenzoic acid alkyl ester - M-hydroxybenzoic acid ester - P-hydroxybenzoic acid ester - Glycosyl compound - O-glycosyl compound - Pinane monoterpenoid - Aromatic monoterpenoid - Nopinane monoterpenoid - Monoterpenoid - Benzoate ester - Benzenetriol - Pyrogallol derivative - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Oxepane - Phenol - Monosaccharide - Dicarboxylic acid or derivatives - Oxane - Oxolane - Secondary alcohol - Ketone - Carboxylic acid ester - Polyol - Organoheterocyclic compound - Oxacycle - Acetal - Carboxylic acid derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aldehyde - Alcohol - Aromatic heteropolycyclic 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