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CHEBI:191750 - 6alpha-Hydroxyphaseollin

Default Structure
ChEBI IDCHEBI:191750
ChEBI Name6alpha-Hydroxyphaseollin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O5
Net Charge0
Average Mass338.359
Monoisotopic Mass338.11542
SMILESCC1(C)C=Cc2cc3c(cc2O1)C1(O)COc2cc(O)ccc2C1O3
InChIInChI=1S/C20H18O5/c1-19(2)6-5-11-7-17-14(9-15(11)25-19)20(22)10-23-16-8-12(21)3-4-13(16)18(20)24-17/h3-9,18,21-22H,10H2,1-2H3
InChIKeyKVUZVBGGLCNPQI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
bark (BTO:0001301) MetaboLights (MTBLS4572)
seed (BTO:0001226) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
6alpha-Hydroxyphaseollin (CHEBI:191750) is a pterocarpans (CHEBI:26377)
IUPAC Name 
6,6-dimethyl-5,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,7,9,14(19),15,17-heptaene-1,17-diol
Manual XrefsDatabases
35013262ChemSpider
HMDB0030771HMDB