CHEBI:190074 - Suprofen glucuronide

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ChEBI Name Suprofen glucuronide
ChEBI ID CHEBI:190074
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H19NO6
Net Charge 0
Average Mass 261.274
Monoisotopic Mass 261.12124
InChI InChI=1S/C11H19NO6/c1-11(2,3-4-12)18-10-9(16)8(15)7(14)6(5-13)17-10/h6-10,13-16H,3,5H2,1-2H3
InChIKey GDSYPXWUHMRTHT-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC(CC#N)(C)C)CO
Metabolite of Species Details
Brassica napus (NCBI:txid3708) Found in flower (BTO:0000469). See: MetaboLights Study
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 Suprofen glucuronide (CHEBI:190074) is a cyanogenic glycoside (CHEBI:23436)
IUPAC Name
3-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanenitrile
Manual Xrefs Databases
112077 ChemSpider
HMDB0034777 HMDB
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