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CHEBI:223890 - Nostotrebinol 3

ChEBI IDCHEBI:223890
ChEBI NameNostotrebinol 3
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H20O6
Net Charge0
Average Mass416.429
Monoisotopic Mass416.12599
SMILESO=C1C(Cc2ccc(O)cc2)=C(Cc2ccc(O)cc2)C(=O)C1(O)c1ccc(O)cc1
InChIInChI=1S/C25H20O6/c26-18-7-1-15(2-8-18)13-21-22(14-16-3-9-19(27)10-4-16)24(30)25(31,23(21)29)17-5-11-20(28)12-6-17/h1-12,26-28,31H,13-14H2
InChIKeyKYSRHPAVQNGVEF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nostoc (ncbitaxon:1177) - PubMed (31977209)
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)
Nostotrebinol 3 (CHEBI:223890) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
2-hydroxy-2-(4-hydroxyphenyl)-4,5-bis[(4-hydroxyphenyl)methyl]cyclopent-4-ene-1,3-dione