Compound Identification
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)C(O)=O
InChIKey
InChIKey=ZRJULXCQDAHLEU-XGUBFFRZSA-N
Formula
C16H16O9
Mass
352.295
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbohydrates and carbohydrate conjugates
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Level 5
Sugar acids and derivatives
- Level 6 Glucuronic acid derivatives
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Level 5
Sugar acids and derivatives
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Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
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Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives
Direct Parent
Glucuronic acid derivatives
Alternative Parents
Butyrophenones Coumarins and derivatives 1-benzopyrans Medium-chain keto acids and derivatives Aryl alkyl ketones Pyranones and derivatives Beta hydroxy acids and derivatives Heterocyclic fatty acids Hydroxy fatty acids Alpha hydroxy acids and derivatives Beta-hydroxy ketones Acyloins Monosaccharides Heteroaromatic compounds Alpha-hydroxy ketones Secondary alcohols Lactones Oxacyclic compounds Carboxylic acids Polyols Monocarboxylic acids and derivatives Hydrocarbon derivatives Aldehydes Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Glucuronic acid or derivatives - Butyrophenone - Coumarin - Benzopyran - 1-benzopyran - Medium-chain keto acid - Aryl alkyl ketone - Aryl ketone - Beta-hydroxy acid - Heterocyclic fatty acid - Hydroxy fatty acid - Pyranone - Fatty acyl - Alpha-hydroxy acid - Acyloin - Beta-hydroxy ketone - Benzenoid - Hydroxy acid - Monosaccharide - Pyran - Alpha-hydroxy ketone - Heteroaromatic compound - Secondary alcohol - Lactone - Ketone - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid - Oxacycle - Carboxylic acid derivative - Aldehyde - Alcohol - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.
External Descriptors
Not available