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CHEBI:190911 - 6-[2-carboxy-2-(hydroxymethyl)-2-methylethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

ChEBI IDCHEBI:190911
ChEBI Name6-[2-carboxy-2-(hydroxymethyl)-2-methylethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18O10
Net Charge0
Average Mass310.255
Monoisotopic Mass310.09000
SMILESCC(CO)(COC1OC(C(=O)O)C(O)C(O)C1O)C(=O)O
InChIInChI=1S/C11H18O10/c1-11(2-12,10(18)19)3-20-9-6(15)4(13)5(14)7(21-9)8(16)17/h4-7,9,12-15H,2-3H2,1H3,(H,16,17)(H,18,19)
InChIKeyFPMYMXMFCSWJAE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
6-[2-carboxy-2-(hydroxymethyl)-2-methylethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:190911) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
6-(2-carboxy-3-hydroxy-2-methylpropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0127649HMDB