Compound Identification
SMILES
[Cl-].CC1=CC=C(C=C1)N=C1SC(=NC2=CC=CC=C2)[NH+](C2=CC=C(C)C=C2)C(SC2O[C@H](COC(=O)C3=CC=CC=C3)[C@@H](OC(=O)C3=CC=CC=C3)[C@H](OC(=O)C3=CC=CC=C3)[C@H]2OC(=O)C2=CC=CC=C2)=N1
InChIKey
InChIKey=NOTXEPJNDVLFCL-DUAMQBEVSA-N
Formula
C57H47ClN4O9S2
Mass
1031.59
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 Thioglycosides
-
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
Thioglycosides
Alternative Parents
Hexoses Benzoic acid esters Benzoyl derivatives Toluenes Oxanes Monothioacetals Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Carboximidamides Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Organic oxides Imines Hydrocarbon derivatives Organic chloride salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hexose monosaccharide - S-glycosyl compound - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Toluene - Monocyclic benzene moiety - Benzenoid - Oxane - Monosaccharide - Monothioacetal - Carboxylic acid ester - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Sulfenyl compound - Carboximidamide - Azacycle - Oxacycle - Organic chloride salt - Organic salt - Organonitrogen compound - Imine - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thioglycosides. These are glycoside in which a sugar group is bonded through one carbon to another group via a S-glycosidic bond.
External Descriptors
Not available