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CHEBI:191444 - Orientin 7,3'-dimethyl ether

ChEBI IDCHEBI:191444
ChEBI NameOrientin 7,3'-dimethyl ether
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H24O11
Net Charge0
Average Mass476.434
Monoisotopic Mass476.13186
SMILES[H][C@@]1(c2c(OC)cc(O)c3c(=O)cc(-c4ccc(O)c(OC)c4)oc23)OC(CO)[C@H](O)[C@H](O)C1O
InChIInChI=1S/C23H24O11/c1-31-14-5-9(3-4-10(14)25)13-6-11(26)17-12(27)7-15(32-2)18(22(17)33-13)23-21(30)20(29)19(28)16(8-24)34-23/h3-7,16,19-21,23-25,27-30H,8H2,1-2H3/t16?,19-,20-,21?,23-/m0/s1
InChIKeySFCOOUKNSXBTFD-RSEIVKCDSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Orientin 7,3'-dimethyl ether (CHEBI:191444) is a C-glycosyl compound (CHEBI:20857)
Orientin 7,3'-dimethyl ether (CHEBI:191444) is a flavonoids (CHEBI:72544)
IUPAC Name 
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-8-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Manual XrefsDatabases
24844001ChemSpider
LMPK12111047LIPID MAPS