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CHEBI:191811 - Rhamnazin 3-sophoroside

ChEBI IDCHEBI:191811
ChEBI NameRhamnazin 3-sophoroside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H34O17
Net Charge0
Average Mass654.574
Monoisotopic Mass654.17960
SMILESCOc1cc(O)c2c(=O)c(OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)c(-c3ccc(O)c(OC)c3)oc2c1
InChIInChI=1S/C29H34O17/c1-40-11-6-13(33)18-15(7-11)42-25(10-3-4-12(32)14(5-10)41-2)26(21(18)36)45-29-27(23(38)20(35)17(9-31)44-29)46-28-24(39)22(37)19(34)16(8-30)43-28/h3-7,16-17,19-20,22-24,27-35,37-39H,8-9H2,1-2H3
InChIKeyWPIJGCCJUFCJAE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Rhamnazin 3-sophoroside (CHEBI:191811) is a flavonoids (CHEBI:72544)
Rhamnazin 3-sophoroside (CHEBI:191811) is a glycoside (CHEBI:24400)
IUPAC Name 
3-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxychromen-4-one
Manual XrefsDatabases
HMDB0038235HMDB