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CHEBI:167934 - 3,4,5-trihydroxy-6-[1-(3-phenyloxiran-2-yl)ethoxy]oxane-2-carboxylic acid

ChEBI IDCHEBI:167934
ChEBI Name3,4,5-trihydroxy-6-[1-(3-phenyloxiran-2-yl)ethoxy]oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O8
Net Charge0
Average Mass340.328
Monoisotopic Mass340.11582
SMILESCC(OC1OC(C(=O)O)C(O)C(O)C1O)C1OC1c1ccccc1
InChIInChI=1S/C16H20O8/c1-7(12-13(23-12)8-5-3-2-4-6-8)22-16-11(19)9(17)10(18)14(24-16)15(20)21/h2-7,9-14,16-19H,1H3,(H,20,21)
InChIKeyAWMSVZXKFIZFCN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-[1-(3-phenyloxiran-2-yl)ethoxy]oxane-2-carboxylic acid (CHEBI:167934) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
3,4,5-trihydroxy-6-[1-(3-phenyloxiran-2-yl)ethoxy]oxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0133742HMDB