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CHEBI:168204 - Phloretin xylosyl-galactoside

ChEBI IDCHEBI:168204
ChEBI NamePhloretin xylosyl-galactoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H32O14
Net Charge0
Average Mass568.528
Monoisotopic Mass568.17921
SMILESO=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O
InChIInChI=1S/C26H32O14/c27-9-17-20(33)22(35)24(40-25-23(36)21(34)18(10-28)38-25)26(39-17)37-16-8-13(30)7-15(32)19(16)14(31)6-3-11-1-4-12(29)5-2-11/h1-2,4-5,7-8,17-18,20-30,32-36H,3,6,9-10H2/t17-,18-,20+,21+,22+,23-,24-,25+,26-/m1/s1
InChIKeyZPVXZDCYCDBKAJ-UZIOSSNQSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Phloretin xylosyl-galactoside (CHEBI:168204) is a flavonoids (CHEBI:72544)
Phloretin xylosyl-galactoside (CHEBI:168204) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[2-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
Manual XrefsDatabases
30776749ChemSpider
HMDB0029252HMDB