Compound Identification
SMILES
CNC(=O)CC(OC)=C(OC1OC(CO)C(O)C(O)C1O)C#N
InChIKey
InChIKey=BASCBPSXFTXREB-UHFFFAOYSA-N
Formula
C13H20N2O8
Mass
332.309
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 Cyanogenic glycosides
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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
Cyanogenic glycosides
Alternative Parents
Fatty acyl glycosides of mono- and disaccharides Alkyl glycosides Hexoses O-glycosyl compounds Oxanes N-acyl amines Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Acetals Nitriles Polyols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Primary alcohols Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Cyanogenic glycoside - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Alkyl glycoside - Hexose monosaccharide - O-glycosyl compound - Fatty acyl - Monosaccharide - N-acyl-amine - Oxane - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Nitrile - Carbonitrile - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Acetal - Polyol - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Primary alcohol - Aliphatic 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