Compound Identification
SMILES
[H]\C(COC1([H])OC([H])(C(O)=O)C([H])(O)C([H])(O)C1([H])O)=C1\S[C@@]([H])(N=C1C)C(O)=O
InChIKey
InChIKey=PVEYRROJKMMVMH-AXZSSGOOSA-N
Formula
C13H17NO9S
Mass
363.34
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
-
Level 7
Glucuronides
- Level 8 O-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
O-glucuronides
Alternative Parents
O-glycosyl compounds Alpha amino acids and derivatives Thiazolecarboxylic acids and derivatives Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Dicarboxylic acids and derivatives Thiazolines Thioenol ethers Secondary alcohols Ketimines Propargyl-type 1,3-dipolar organic compounds Polyols Oxacyclic compounds Carboxylic acids Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
O-glucuronide - 1-o-glucuronide - O-glycosyl compound - Glycosyl compound - Alpha-amino acid or derivatives - Thiazolecarboxylic acid or derivatives - Beta-hydroxy acid - Pyran - Oxane - Monosaccharide - Hydroxy acid - Dicarboxylic acid or derivatives - Meta-thiazoline - Thiazole - Thioenolether - Secondary alcohol - Ketimine - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Polyol - Carboxylic acid - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Imine - Carbonyl group - Alcohol - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond.
External Descriptors
Not available