Compound Identification
SMILES
CS[C@@]1(C[C@H](OC(=O)C2=CC=CC=C2)[C@@H](NC(=O)COCC2=CC=CC=C2)[C@@H](O1)[C@H](O)[C@H](O)COC(=O)C1=CC=CC=C1)C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=CWKZIHRCQAGRCO-AHKCNZKASA-N
Formula
C40H41NO11S
Mass
743.82
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 C-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
C-glucuronides
Alternative Parents
C-glycosyl compounds Benzoic acid esters Benzyloxycarbonyls Benzylethers Benzoyl derivatives Monothioketals Pyrans Oxanes Carboxylic acid esters 1,2-diols Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
C-glucuronide - C-glycosyl compound - Glycosyl compound - Benzoate ester - Benzyloxycarbonyl - Benzoic acid or derivatives - Benzylether - Benzoyl - Monothioketal - Benzenoid - Monocyclic benzene moiety - Pyran - Oxane - Monothioacetal - Secondary carboxylic acid amide - 1,2-diol - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Sulfenyl compound - Organoheterocyclic compound - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organic nitrogen compound - Alcohol - Organosulfur compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as c-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through a C-glycosidic bond.
External Descriptors
Not available