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CHEBI:197252 - Syringetin 3-(6'''-acetylglucosyl)(1->3)-galactoside

ChEBI IDCHEBI:197252
ChEBI NameSyringetin 3-(6'''-acetylglucosyl)(1->3)-galactoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H36O19
Net Charge0
Average Mass712.610
Monoisotopic Mass712.18508
SMILESCOc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2OC(CO)[C@H](O)C(O[C@@H]3OC(COC(C)=O)[C@@H](O)[C@H](O)C3O)[C@H]2O)cc(OC)c1O
InChIInChI=1S/C31H36O19/c1-10(33)45-9-18-21(37)24(40)25(41)30(48-18)49-28-22(38)17(8-32)47-31(26(28)42)50-29-23(39)19-13(35)6-12(34)7-14(19)46-27(29)11-4-15(43-2)20(36)16(5-11)44-3/h4-7,17-18,21-22,24-26,28,30-32,34-38,40-42H,8-9H2,1-3H3/t17?,18?,21-,22+,24+,25?,26-,28?,30+,31+/m1/s1
InChIKeyBHRTWWYZDFOMPD-HOHZMZQUSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
Syringetin 3-(6'''-acetylglucosyl)(1->3)-galactoside (CHEBI:197252) is a flavonoids (CHEBI:72544)
Syringetin 3-(6'''-acetylglucosyl)(1->3)-galactoside (CHEBI:197252) is a glycoside (CHEBI:24400)
IUPAC Name 
[(3S,4S,6S)-6-[(2S,3R,5S)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Manual XrefsDatabases
LMPK12112485LIPID MAPS
24845172ChemSpider