Compound Identification
SMILES
OC1C(O)C(OC2CNCC(C2)c2ccc(cc2)-n2cc3cccc(C(O)=N)c3n2)OC(C1O)C(O)=O
InChIKey
InChIKey=UPMQQBUWZZJDOG-UHFFFAOYSA-N
Formula
C25H28N4O8
Mass
512.519
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 O-glucuronides
-
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
O-glucuronides
Alternative Parents
Phenylpiperidines Phenylpyrazoles O-glycosyl compounds Indazoles Aralkylamines Beta hydroxy acids and derivatives Pyrans Oxanes Benzene and substituted derivatives Monosaccharides Heteroaromatic compounds Secondary alcohols Amino acids Acetals Polyols Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Carboximidic acids Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-o-glucuronide - O-glucuronide - Phenylpiperidine - Glycosyl compound - O-glycosyl compound - Phenylpyrazole - Benzopyrazole - Indazole - Beta-hydroxy acid - Aralkylamine - Monocyclic benzene moiety - Hydroxy acid - Monosaccharide - Oxane - Piperidine - Pyran - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Secondary alcohol - Secondary amine - Oxacycle - Monocarboxylic acid or derivatives - Acetal - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Carboximidic acid derivative - Carboximidic acid - Polyol - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Alcohol - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic 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