Compound Identification
SMILES
COC(=O)C1OC(OC2=C(C(=O)C(OC3OC(C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(=O)OC)=C(C2=O)C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
InChIKey
InChIKey=RJRJGFYJDKOEKG-UHFFFAOYSA-N
Formula
C46H48O24
Mass
984.866
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
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Level 6
Glucuronic acid derivatives
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Level 7
Glucuronides
- Level 8 O-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
O-glucuronides
Alternative Parents
O-glycosyl compounds Phenoxy compounds P-benzoquinones Methoxybenzenes Anisoles Alkyl aryl ethers Pyrans Oxanes Monosaccharides Vinylogous esters Methyl esters Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-o-glucuronide - O-glucuronide - Glycosyl compound - O-glycosyl compound - Phenoxy compound - Anisole - Methoxybenzene - P-benzoquinone - Phenol ether - Quinone - Alkyl aryl ether - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Oxane - Pyran - Vinylogous ester - Methyl ester - Ketone - Carboxylic acid ester - Cyclic ketone - Organoheterocyclic compound - Oxacycle - Ether - Carboxylic acid derivative - Acetal - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond.
External Descriptors
Not available