Compound Identification
SMILES
CCS[C@@H]1O[C@@H]([C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1O)C(=O)OC
InChIKey
InChIKey=YAZFIPBSHFHFIB-RBRWEJTLSA-N
Formula
C23H28O6S
Mass
432.53
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
-
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 Benzylethers Pyrans Oxanes Monosaccharides Monothioacetals Methyl esters Secondary alcohols Sulfenyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-s-glucuronide - S-glucuronide - Glycosyl compound - S-glycosyl compound - Benzylether - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Oxane - Pyran - Methyl ester - Monothioacetal - Carboxylic acid ester - Secondary alcohol - Sulfenyl compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - 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