Compound Identification
SMILES
COC1=CC=C(C=C1)C1C(C#N)=C(S)N(C2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(C2=CC=CC=C2)=C1C(C)=O
InChIKey
InChIKey=WYVFDWPBTOGGCO-UHFFFAOYSA-N
Formula
C35H36N2O11S
Mass
692.74
Taxonomic Classification
Taxonomy Tree
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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
Tetracarboxylic acids and derivatives Glycosylamines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Dihydropyridines Monosaccharides Oxanes Vinylogous amides Ketones Ketene acetals Carboxylic acid esters Nitriles Oxacyclic compounds Alkylthiols Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cyanogenic glycoside - Tetracarboxylic acid or derivatives - N-glycosyl compound - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Dihydropyridine - Monosaccharide - Hydropyridine - Oxane - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Ketone - Carboxylic acid ester - Ketene acetal or derivatives - Alkylthiol - Carboxylic acid derivative - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Nitrile - Carbonitrile - Organopnictogen compound - Organic oxide - Carbonyl group - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - 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