Compound Identification
SMILES
CC(O)(C(O)C(O)C=O)C(O)C(O)=O.CC1(OC(O)C(O)C1O)C(O)C(O)=O.CC1(O)C(O)C(O)C(O)OC1C(O)=O
InChIKey
InChIKey=GIBNHWILBWUVAE-UHFFFAOYSA-N
Formula
C21H36O21
Mass
624.498
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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
Medium-chain hydroxy acids and derivatives Medium-chain fatty acids Methyl-branched fatty acids Hydroxy fatty acids Pyrans Alpha hydroxy acids and derivatives Oxanes Beta-hydroxy aldehydes Monosaccharides Tetrahydrofurans Tertiary alcohols Alpha-hydroxyaldehydes Secondary alcohols Hemiacetals Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Glucuronic acid or derivatives - Medium-chain hydroxy acid - Medium-chain fatty acid - Branched fatty acid - Hydroxy fatty acid - Methyl-branched fatty acid - Alpha-hydroxy acid - Beta-hydroxy aldehyde - Hydroxy acid - Fatty acyl - Monosaccharide - Oxane - Pyran - Fatty acid - Alpha-hydroxyaldehyde - Tetrahydrofuran - Tertiary alcohol - Secondary alcohol - Hemiacetal - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Polyol - Carboxylic acid - Oxacycle - Carbonyl group - Aldehyde - Organic oxide - Hydrocarbon derivative - Alcohol - Aliphatic heteromonocyclic 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