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CHEBI:168406 - 6-Hydroxytricetin 6,4',5'-trimethyl eter 3'-rhamnoside

ChEBI IDCHEBI:168406
ChEBI Name6-Hydroxytricetin 6,4',5'-trimethyl eter 3'-rhamnoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26O12
Net Charge0
Average Mass506.460
Monoisotopic Mass506.14243
SMILESCOc1cc(-c2cc(=O)c3c(O)c(OC)c(O)cc3o2)cc(O[C@@H]2OC(C)[C@H](O)C(O)[C@@H]2O)c1OC
InChIInChI=1S/C24H26O12/c1-9-18(27)20(29)21(30)24(34-9)36-16-6-10(5-15(31-2)23(16)33-4)13-7-11(25)17-14(35-13)8-12(26)22(32-3)19(17)28/h5-9,18,20-21,24,26-30H,1-4H3/t9?,18-,20?,21-,24-/m0/s1
InChIKeyYHFWTZYZLODTMZ-CIJVZNLHSA-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)
6-Hydroxytricetin 6,4',5'-trimethyl eter 3'-rhamnoside (CHEBI:168406) is a flavonoids (CHEBI:72544)
6-Hydroxytricetin 6,4',5'-trimethyl eter 3'-rhamnoside (CHEBI:168406) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[3,4-dimethoxy-5-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]-5,7-dihydroxy-6-methoxychromen-4-one
Manual XrefsDatabases
24844164ChemSpider
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