Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(C=C1[N+]([O-])=O)N(O)C1OC(C(O)C(O)C1O)C(O)=O)[N+]([O-])=O

InChIKey

InChIKey=SGMKMCLDFBNOLX-UHFFFAOYSA-N

Formula

C13H15N3O11

Mass

389.273

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Taxonomic Classification

Taxonomy Tree

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

N-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-glucuronide - N-glycosyl compound - Glycosyl compound - Nitrotoluene - Nitrobenzene - Nitro fatty acid - N-phenylhydroxylamine - 1-hydroxylamino, 2-unsubstituted benzenoid - Nitroaromatic compound - Short-chain hydroxy acid - Hydroxy fatty acid - Heterocyclic fatty acid - Branched fatty acid - Beta-hydroxy acid - Fatty acyl - Benzenoid - Pyran - Oxane - Hydroxy acid - Monocyclic benzene moiety - Organic nitro compound - Secondary alcohol - C-nitro compound - Oxacycle - N-organohydroxylamine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Polyol - Organic oxoazanium - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic hyponitrite - Alcohol - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through a N-glycosidic bond.

External Descriptors

Not available

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