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CHEBI:168331 - Persicogenin 3'-glucoside

ChEBI IDCHEBI:168331
ChEBI NamePersicogenin 3'-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O11
Net Charge0
Average Mass478.450
Monoisotopic Mass478.14751
SMILESCOc1cc(O)c2c(c1)OC(c1ccc(OC)c(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c1)CC2=O
InChIInChI=1S/C23H26O11/c1-30-11-6-12(25)19-13(26)8-15(32-17(19)7-11)10-3-4-14(31-2)16(5-10)33-23-22(29)21(28)20(27)18(9-24)34-23/h3-7,15,18,20-25,27-29H,8-9H2,1-2H3/t15?,18?,20-,21+,22?,23-/m1/s1
InChIKeyVHGJMSVFUPCQGC-ZCKZEFSYSA-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)
Persicogenin 3'-glucoside (CHEBI:168331) is a flavonoids (CHEBI:72544)
Persicogenin 3'-glucoside (CHEBI:168331) is a glycoside (CHEBI:24400)
IUPAC Name 
5-hydroxy-7-methoxy-2-[4-methoxy-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846577ChemSpider
LMPK12140587LIPID MAPS