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CHEBI:191752 - 6''-O-Malonylnaringin

ChEBI IDCHEBI:191752
ChEBI Name6''-O-Malonylnaringin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H34O17
Net Charge0
Average Mass666.585
Monoisotopic Mass666.17960
SMILESCC1OC(OC2C(Oc3cc(O)c4c(c3)OC(c3ccc(O)cc3)CC4=O)OC(COC(=O)CC(=O)O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C30H34O17/c1-11-23(37)25(39)27(41)29(43-11)47-28-26(40)24(38)19(10-42-21(36)9-20(34)35)46-30(28)44-14-6-15(32)22-16(33)8-17(45-18(22)7-14)12-2-4-13(31)5-3-12/h2-7,11,17,19,23-32,37-41H,8-10H2,1H3,(H,34,35)
InChIKeyYCOQCRMFNLZUCL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
bark (BTO:0001301) MetaboLights (MTBLS4572)
seed (BTO:0001226) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
6''-O-Malonylnaringin (CHEBI:191752) is a flavonoids (CHEBI:72544)
6''-O-Malonylnaringin (CHEBI:191752) is a glycoside (CHEBI:24400)
IUPAC Name 
3-[[3,4-dihydroxy-6-[[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl]oxy]-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]methoxy]-3-oxopropanoic acid
Manual XrefsDatabases
HMDB0039776HMDB