CHEBI:156184 - Dhurrin 6'-glucoside

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Dhurrin 6'-glucoside
ChEBI ID CHEBI:156184
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
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Formula C20H27NO12
Net Charge 0
Average Mass 473.431
Monoisotopic Mass 473.15333
InChI InChI=1S/C20H27NO12/c21-5-10(8-1-3-9(23)4-2-8)31-20-18(29)16(27)14(25)12(33-20)7-30-19-17(28)15(26)13(24)11(6-22)32-19/h1-4,10-20,22-29H,6-7H2
InChIKey FPYKJQSRWXKDRY-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC(C2=CC=C(O)C=C2)C#N)COC3OC(C(O)C(O)C3O)CO
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via cyanogenic glycoside )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Dhurrin 6'-glucoside (CHEBI:156184) is a cyanogenic glycoside (CHEBI:23436)
IUPAC Name
2-(4-hydroxyphenyl)-2-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile