Compound Identification
SMILES
OC1C(OC(C(O)C1O)C(O)=O)SC1=NC=NC2=C1NC=N2
InChIKey
InChIKey=GEEUITSLAJGZSK-UHFFFAOYSA-N
Formula
C11H12N4O6S
Mass
328.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Sugar acids and derivatives
-
Level 6
Glucuronic acid derivatives
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Level 7
Glucuronides
- Level 8 S-glucuronides
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Level 7
Glucuronides
-
Level 6
Glucuronic acid derivatives
-
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 - Glucuronic acid derivatives - Glucuronides
Direct Parent
S-glucuronides
Alternative Parents
Thioglycosides 6-thiopurines Aryl thioethers Beta hydroxy acids and derivatives Pyrimidines and pyrimidine derivatives Pyrans Oxanes Monosaccharides Heteroaromatic compounds Imidazoles Monothioacetals Secondary alcohols Sulfenyl compounds Polyols Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
S-glucuronide - 1-s-glucuronide - Glycosyl compound - S-glycosyl compound - 6-thiopurine - Purine - Imidazopyrimidine - Aryl thioether - Beta-hydroxy acid - Oxane - Pyran - Pyrimidine - Hydroxy acid - Monosaccharide - Heteroaromatic compound - Monothioacetal - Imidazole - Azole - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Sulfenyl compound - Polyol - Organic nitrogen compound - Organic oxide - Carbonyl group - Alcohol - Hydrocarbon derivative - Organonitrogen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as s-glucuronides. These are carbohydrate derivatives containing glucuronic acid linked to another substance through a S-glycosidic bond.
External Descriptors
Not available