EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:201883 - Epiphorellic acid 1

ChEBI IDCHEBI:201883
ChEBI NameEpiphorellic acid 1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H34O8
Net Charge0
Average Mass474.550
Monoisotopic Mass474.22537
SMILESCCCCCc1cc(O)cc(Oc2c(OC)cc(O)c(C(=O)O)c2CCCCC)c1C(=O)OC
InChIInChI=1S/C26H34O8/c1-5-7-9-11-16-13-17(27)14-20(22(16)26(31)33-4)34-24-18(12-10-8-6-2)23(25(29)30)19(28)15-21(24)32-3/h13-15,27-28H,5-12H2,1-4H3,(H,29,30)
InChIKeyFVGIGMWEANQQSW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Epiphorellic acid 1 (CHEBI:201883) is a aromatic ether (CHEBI:35618)
IUPAC Name 
6-hydroxy-3-(5-hydroxy-2-methoxycarbonyl-3-pentylphenoxy)-4-methoxy-2-pentylbenzoic acid
Manual XrefsDatabases
156487ChemSpider