Compound Identification
SMILES
CO[C@@H]([C@@H](O)CO)C1O[C@@](C[C@H](N=C(N)N)[C@H]1NC(C)=O)(OC1=CC(OC)=C(C=O)C=C1)C(O)=O
InChIKey
InChIKey=YOAQUOZGFLOJNI-KONDLLAPSA-N
Formula
C21H30N4O10
Mass
498.489
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
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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
C-glucuronides
Alternative Parents
Gamma amino acids and derivatives C-glycosyl compounds Phenoxyacetic acid derivatives Anisoles Benzaldehydes Benzoyl derivatives Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Ketals Oxanes Pyrans Acetamides 1,2-diols Secondary carboxylic acid amides Secondary alcohols Guanidines Oxacyclic compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Carboximidamides Dialkyl ethers Carboxylic acids Organic oxides Organopnictogen compounds Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
C-glucuronide - Gamma amino acid or derivatives - Glycosyl compound - Phenoxyacetate - C-glycosyl compound - Phenol ether - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Benzaldehyde - Ketal - Aryl-aldehyde - Alkyl aryl ether - Benzenoid - Pyran - Oxane - Monocyclic benzene moiety - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Guanidine - 1,2-diol - Acetal - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organopnictogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Primary alcohol - Organonitrogen compound - Aldehyde - 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