CHEBI:203445 - Phelligridin H

ChEBI IDCHEBI:203445
ChEBI NamePhelligridin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC33H18O13
Net Charge0
Average Mass622.494
Monoisotopic Mass622.07474
SMILESO=c1oc2cc(-c3c(-c4ccc(O)c(O)c4)oc4cc(/C=C/c5ccc(O)c(O)c5)oc(=O)c34)oc(=O)c2c2cc(O)c(O)cc12
InChIInChI=1S/C33H18O13/c34-18-5-2-13(7-20(18)36)1-4-15-9-24-29(33(42)43-15)28(30(44-24)14-3-6-19(35)21(37)8-14)26-12-25-27(32(41)46-26)16-10-22(38)23(39)11-17(16)31(40)45-25/h1-12,34-39H/b4-1+
InChIKeyPGRXQKVGAJTEBU-DAFODLJHSA-N
Species of MetaboliteComponentSourceComments
Phellinus igniarius (ncbitaxon:40472) - PubMed (17279797)
ChEBI Ontology
Outgoing Relation(s)
Phelligridin H (CHEBI:203445) is a isocoumarins (CHEBI:38758)
IUPAC Name 
3-[2-(3,4-dihydroxyphenyl)-6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-oxouro[3,2-c]pyran-3-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione
Manual XrefsDatabases
17267228ChemSpider