Compound Identification
SMILES
OCC(=O)N[C@@H]1[C@@H](O)C[C@@](OCc2ccc(cc2)C#C)(O[C@H]1[C@H](O)[C@H](O)CNC(=O)Cc1ccc(cc1)-c1ccc(O)cc1)C(O)=O
InChIKey
InChIKey=CXFJDDACTPLXKH-LQPMBOCWSA-N
Formula
C34H36N2O11
Mass
648.665
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
-
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 Phenylacetamides Short-chain hydroxy acids and derivatives Ketals Hydroxy fatty acids Heterocyclic fatty acids 1-hydroxy-2-unsubstituted benzenoids Pyrans Oxanes N-acyl amines Secondary alcohols Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carboxylic acid amides Acetylides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
C-glucuronide - Glycosyl compound - C-glycosyl compound - Phenylacetamide - 1-hydroxy-2-unsubstituted benzenoid - Ketal - Short-chain hydroxy acid - Phenol - Hydroxy fatty acid - Heterocyclic fatty acid - Fatty acyl - Benzenoid - Pyran - Oxane - N-acyl-amine - Monocyclic benzene moiety - Secondary alcohol - Carboxamide group - Acetylide - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Alcohol - 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