Compound Identification
SMILES
O.O.[Na+].OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1ONNC(=O)C1=CC=NC=C1)C([O-])=O
InChIKey
InChIKey=FHUDWIWLRQPYKQ-UUOIAJFTSA-M
Formula
C12H18N3NaO10
Mass
387.277
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
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
-
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
Pyridinecarboxylic acids and derivatives Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Heteroaromatic compounds Secondary alcohols 1,2-diols Carboxylic acid salts Hemiacetals Oxacyclic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Glucuronic acid or derivatives - Pyridine carboxylic acid or derivatives - Beta-hydroxy acid - Hydroxy acid - Monosaccharide - Oxane - Pyran - Pyridine - Heteroaromatic compound - 1,2-diol - Carboxylic acid salt - Hemiacetal - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organic alkali metal salt - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Polyol - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic sodium salt - Organonitrogen compound - Hydrocarbon derivative - Alcohol - Organic salt - Organic zwitterion - Aromatic 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