Compound Identification
SMILES
COC(=O)[C@@H]1O[C@H](SC2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@@H]1O
InChIKey
InChIKey=YBBDVVDSPUSOMT-NSXQJRSDSA-N
Formula
C27H26O7S
Mass
494.56
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
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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 Benzoic acid esters Benzylethers Aryl thioethers Benzoyl derivatives Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Monothioacetals Methyl esters Secondary alcohols Sulfenyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
S-glucuronide - 1-s-glucuronide - Glycosyl compound - S-glycosyl compound - Benzoate ester - Benzoic acid or derivatives - Benzylether - Aryl thioether - Benzoyl - Beta-hydroxy acid - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - Monosaccharide - Oxane - Pyran - Methyl ester - Monothioacetal - Secondary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Sulfenyl compound - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Aromatic 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