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CHEBI:189522 - Desoxyrhaponticin

ChEBI IDCHEBI:189522
ChEBI NameDesoxyrhaponticin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O8
Net Charge0
Average Mass404.415
Monoisotopic Mass404.14712
SMILESCOc1ccc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1
InChIInChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1
InChIKeyMFMQRDLLSRLUJY-DXKBKAGUSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) leaf sheath (BTO:0005094) MetaboLights (MTBLS3518)
ChEBI Ontology
Outgoing Relation(s)
Desoxyrhaponticin (CHEBI:189522) is a glycoside (CHEBI:24400)
Desoxyrhaponticin (CHEBI:189522) is a stilbenoid (CHEBI:26776)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
4475625ChemSpider
LSM-42887LINCS