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CHEBI:192854 - Isorhamnetin 3-O-[b-D-xylopyranosyl-(1->6)-b-D-glucopyranoside]

ChEBI IDCHEBI:192854
ChEBI NameIsorhamnetin 3-O-[b-D-xylopyranosyl-(1->6)-b-D-glucopyranoside]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H30O16
Net Charge0
Average Mass610.521
Monoisotopic Mass610.15338
SMILESCOc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)ccc1O
InChIInChI=1S/C27H30O16/c1-38-14-4-9(2-3-11(14)29)24-25(20(34)17-12(30)5-10(28)6-15(17)41-24)43-27-23(37)21(35)19(33)16(42-27)8-40-26-22(36)18(32)13(31)7-39-26/h2-6,13,16,18-19,21-23,26-33,35-37H,7-8H2,1H3
InChIKeyHIRWMGZVIYIRJM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS4099) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Isorhamnetin 3-O-[b-D-xylopyranosyl-(1->6)-b-D-glucopyranoside] (CHEBI:192854) is a flavonoids (CHEBI:72544)
Isorhamnetin 3-O-[b-D-xylopyranosyl-(1->6)-b-D-glucopyranoside] (CHEBI:192854) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
Manual XrefsDatabases
HMDB0040490HMDB