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CHEBI:192843 - Xanthochymuside

ChEBI IDCHEBI:192843
ChEBI NameXanthochymuside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H32O16
Net Charge0
Average Mass720.636
Monoisotopic Mass720.16903
SMILESO=C1CC(c2ccc(O)c(O)c2)Oc2c1c(O)cc(OC1OC(CO)C(O)C(O)C1O)c2C1C(=O)c2c(O)cc(O)cc2OC1c1ccc(O)cc1
InChIInChI=1S/C36H32O16/c37-12-25-30(45)32(47)33(48)36(52-25)51-24-11-21(44)26-20(43)10-22(14-3-6-17(40)18(41)7-14)49-35(26)28(24)29-31(46)27-19(42)8-16(39)9-23(27)50-34(29)13-1-4-15(38)5-2-13/h1-9,11,22,25,29-30,32-34,36-42,44-45,47-48H,10,12H2
InChIKeyXGQOXAVFFQEOBL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS4099) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Xanthochymuside (CHEBI:192843) is a flavonoid oligomer (CHEBI:72720)
IUPAC Name 
8-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
HMDB0030609HMDB