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CHEBI:200650 - Methylphelligrin B

ChEBI IDCHEBI:200650
ChEBI NameMethylphelligrin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H20O6
Net Charge0
Average Mass392.407
Monoisotopic Mass392.12599
SMILESCOc1cc(O)c2c(c1Cc1ccccc1O)O[C@@H](c1ccc(O)cc1)CC2=O
InChIInChI=1S/C23H20O6/c1-28-21-12-19(27)22-18(26)11-20(13-6-8-15(24)9-7-13)29-23(22)16(21)10-14-4-2-3-5-17(14)25/h2-9,12,20,24-25,27H,10-11H2,1H3/t20-/m1/s1
InChIKeyBOEWXOMRJRXFIU-HXUWFJFHSA-N
Species of MetaboliteComponentSourceComments
Sanghuangporus baumii (ncbitaxon:108892) - PubMed (21531558)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
Methylphelligrin B (CHEBI:200650) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
(2R)-5-hydroxy-2-(4-hydroxyphenyl)-8-[(2-hydroxyphenyl)methyl]-7-methoxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
26338735ChemSpider