EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:216919 - Phelligridin F

ChEBI IDCHEBI:216919
ChEBI NamePhelligridin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H22O9
Net Charge0
Average Mass478.453
Monoisotopic Mass478.12638
SMILESCO[C@@]1(CC(C)=O)Oc2cc(/C=C/c3ccc(O)c(O)c3)oc(=O)c2/C1=C/c1ccc(O)c(O)c1
InChIInChI=1S/C26H22O9/c1-14(27)13-26(33-2)18(9-16-5-8-20(29)22(31)11-16)24-23(35-26)12-17(34-25(24)32)6-3-15-4-7-19(28)21(30)10-15/h3-12,28-31H,13H2,1-2H3/b6-3+,18-9-/t26-/m0/s1
InChIKeyWBJFOHSVLCPQAU-UUGDNKJCSA-N
Species of MetaboliteComponentSourceComments
Phellinus igniarius (ncbitaxon:40472) - PubMed (15165144)
ChEBI Ontology
Outgoing Relation(s)
Phelligridin F (CHEBI:216919) is a catechols (CHEBI:33566)
IUPAC Name 
(3Z)-6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-3-[(3,4-dihydroxyphenyl)methylidene]-2-methoxy-2-(2-oxopropyl)uro[3,2-c]pyran-4-one
Manual XrefsDatabases
9629249ChemSpider