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CHEBI:192030 - 2''-(6-Acetylglucosyl)astragalin

ChEBI IDCHEBI:192030
ChEBI Name2''-(6-Acetylglucosyl)astragalin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H32O17
Net Charge0
Average Mass652.558
Monoisotopic Mass652.16395
SMILESCC(=O)OCC1OC(OC2C(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)OC(CO)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C29H32O17/c1-10(31)41-9-17-20(36)22(38)24(40)28(44-17)46-27-23(39)19(35)16(8-30)43-29(27)45-26-21(37)18-14(34)6-13(33)7-15(18)42-25(26)11-2-4-12(32)5-3-11/h2-7,16-17,19-20,22-24,27-30,32-36,38-40H,8-9H2,1H3
InChIKeyCDTNLNYMZSMCGJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
ChEBI Ontology
Outgoing Relation(s)
2''-(6-Acetylglucosyl)astragalin (CHEBI:192030) is a flavonoids (CHEBI:72544)
2''-(6-Acetylglucosyl)astragalin (CHEBI:192030) is a glycoside (CHEBI:24400)
IUPAC Name 
[6-[2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Manual XrefsDatabases
HMDB0040474HMDB