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CHEBI:214594 - Retipolide E

ChEBI IDCHEBI:214594
ChEBI NameRetipolide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H20O8
Net Charge0
Average Mass460.438
Monoisotopic Mass460.11582
SMILESO=C1O[C@]2(Cc3ccc(cc3)Oc3cc(ccc3O)CCOC2=O)C(c2ccc(O)cc2)=C1O
InChIInChI=1S/C26H20O8/c27-18-6-4-17(5-7-18)22-23(29)24(30)34-26(22)14-16-1-8-19(9-2-16)33-21-13-15(3-10-20(21)28)11-12-32-25(26)31/h1-10,13,27-29H,11-12,14H2/t26-/m1/s1
InChIKeyZEWUQXZTPTVEAO-AREMUKBSSA-N
Species of MetaboliteComponentSourceComments
Retiboletus (ncbitaxon:889442) - DOI (10.1002/ejoc.200700579)
ChEBI Ontology
Outgoing Relation(s)
Retipolide E (CHEBI:214594) is a aromatic ether (CHEBI:35618)
IUPAC Name 
(12R)-3',4-dihydroxy-4'-(4-hydroxyphenyl)spiro[2,10-dioxatricyclo[12.2.2.13,7]nonadeca-1(16),3,5,7(19),14,17-hexaene-12,5'-uran]-2',11-dione
Manual XrefsDatabases
28284231ChemSpider