Compound Identification
SMILES
NC1=C(C#N)C(C2=CC=C(C=C2)[N+]([O-])=O)C(C#N)=C(N1)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
InChIKey=FTTCUSPCQJUTLY-VICSCFSLSA-N
Formula
C19H19N5O7S
Mass
461.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
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Level 5
Glycosyl compounds
- Level 6 Cyanogenic glycosides
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Level 5
Glycosyl compounds
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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
Cyanogenic glycosides
Alternative Parents
Hexoses Thioglycosides Nitrobenzenes Nitroaromatic compounds Dihydropyridines Oxanes Monothioacetals Secondary alcohols 1,2-diols Ketene acetals Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Amines Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cyanogenic glycoside - Hexose monosaccharide - S-glycosyl compound - Nitrobenzene - Nitroaromatic compound - Dihydropyridine - Hydropyridine - Monosaccharide - Monocyclic benzene moiety - Benzenoid - Oxane - Monothioacetal - Organic nitro compound - Ketene acetal or derivatives - C-nitro compound - Secondary alcohol - 1,2-diol - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Polyol - Sulfenyl compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organonitrogen compound - Organosulfur compound - Organic zwitterion - Amine - Primary alcohol - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cyanogenic glycosides. These are glycosides in which the aglycone moiety contains a cyanide group.
External Descriptors
Not available