Compound Identification
SMILES
CC1=NC2=C(C=C(Br)C=C2)C(=O)N1C1=CC=C(NC2OC(CO)C(O)C(O)C2O)C=C1
InChIKey
InChIKey=SGIQWIIDVMJDOA-UHFFFAOYSA-N
Formula
C21H22BrN3O6
Mass
492.326
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Glycosyl compounds
- Level 6 Glycosylamines
-
Level 5
Glycosyl compounds
-
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
Glycosyl compounds
Direct Parent
Glycosylamines
Alternative Parents
Hexoses Quinazolines Aniline and substituted anilines Phenylalkylamines Secondary alkylarylamines Pyrimidones Aryl bromides Oxanes Heteroaromatic compounds Secondary alcohols Lactams Polyols Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Primary alcohols Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hexose monosaccharide - N-glycosyl compound - Diazanaphthalene - Quinazoline - Aniline or substituted anilines - Phenylalkylamine - Pyrimidone - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Monosaccharide - Oxane - Pyrimidine - Heteroaromatic compound - Lactam - Secondary alcohol - Polyol - Azacycle - Oxacycle - Secondary amine - Organoheterocyclic compound - Primary alcohol - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as glycosylamines. These are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether).
External Descriptors
Not available