EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:225411 - Phomosine E

ChEBI IDCHEBI:225411
ChEBI NamePhomosine E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O8
Net Charge0
Average Mass392.404
Monoisotopic Mass392.14712
SMILESCOCOCc1c(O)cc(C)cc1Oc1c(C)c(C(=O)OC)c(O)c(C)c1O
InChIInChI=1S/C20H24O8/c1-10-6-14(21)13(8-27-9-25-4)15(7-10)28-19-11(2)16(20(24)26-5)17(22)12(3)18(19)23/h6-7,21-23H,8-9H2,1-5H3
InChIKeyHIHMFZVTAJBXCV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - DOI (10.1002/ejoc.200500471)
ChEBI Ontology
Outgoing Relation(s)
Phomosine E (CHEBI:225411) is a aromatic ether (CHEBI:35618)
IUPAC Name 
methyl 2,4-dihydroxy-5-[3-hydroxy-2-(methoxymethoxymethyl)-5-methylphenoxy]-3,6-dimethylbenzoate
Manual XrefsDatabases
78435055ChemSpider