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CHEBI:206425 - Thelephantin I

ChEBI IDCHEBI:206425
ChEBI NameThelephantin I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H18O7
Net Charge0
Average Mass442.423
Monoisotopic Mass442.10525
SMILESCOC1=C(c2ccc(O)cc2)C(=O)C(OC(=O)c2ccccc2)=C(c2ccc(O)cc2)C1=O
InChIInChI=1S/C26H18O7/c1-32-24-20(15-7-11-18(27)12-8-15)23(30)25(33-26(31)17-5-3-2-4-6-17)21(22(24)29)16-9-13-19(28)14-10-16/h2-14,27-28H,1H3
InChIKeyHEMLZBDBIFMMOI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Hydnellum caeruleum (ncbitaxon:268276) - PubMed (15110701)
ChEBI Ontology
Outgoing Relation(s)
Thelephantin I (CHEBI:206425) is a benzoate ester (CHEBI:36054)
IUPAC Name 
[2,5-bis(4-hydroxyphenyl)-4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl] benzoate
Manual XrefsDatabases
10187822ChemSpider