Compound Identification
SMILES
[H]C1(O)C([H])(O)C([H])(OC([H])(C(O)=O)C1([H])O)SC(S)=C(C(=O)OC(C)C)C(=O)OC(C)C
InChIKey
InChIKey=BBFTWLAOGHKVNW-UHFFFAOYSA-N
Formula
C16H24O10S2
Mass
440.48
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 S-glucuronides
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Level 7
Glucuronides
-
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 - Glucuronic acid derivatives - Glucuronides
Direct Parent
S-glucuronides
Alternative Parents
Thioglycosides Tricarboxylic acids and derivatives Beta hydroxy acids and derivatives Vinylogous thioesters Pyrans Oxanes Monosaccharides Monothioacetals Enoate esters Secondary alcohols Ketene acetals Hemiacetals Dithiohemiacetals Sulfenyl compounds Polyols Oxacyclic compounds Carboxylic acids Alkylthiols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
1-s-glucuronide - S-glucuronide - S-glycosyl compound - Glycosyl compound - Tricarboxylic acid or derivatives - Beta-hydroxy acid - Vinylogous thioester - Pyran - Oxane - Monosaccharide - Hydroxy acid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Monothioacetal - Secondary alcohol - Ketene acetal or derivatives - Hemiacetal - Dithiohemiacetal - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Polyol - Carboxylic acid - Carboxylic acid derivative - Alkylthiol - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Alcohol - Aliphatic heteromonocyclic 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