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CHEBI:217065 - Phomopside B

ChEBI IDCHEBI:217065
ChEBI NamePhomopside B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O7
Net Charge0
Average Mass330.292
Monoisotopic Mass330.07395
SMILESCc1cc(O)c(C=O)c(Oc2c(O)c(C)c3c(c2O)C(=O)OC3)c1
InChIInChI=1S/C17H14O7/c1-7-3-11(19)9(5-18)12(4-7)24-16-14(20)8(2)10-6-23-17(22)13(10)15(16)21/h3-5,19-21H,6H2,1-2H3
InChIKeyPBKRVJIQYYYZMX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phomopsisspecies ZZF08 (ncbitaxon:481304) - PubMed (18449854)
ChEBI Ontology
Outgoing Relation(s)
Phomopside B (CHEBI:217065) is a aromatic ether (CHEBI:35618)
IUPAC Name 
2-[(4,6-dihydroxy-7-methyl-3-oxo-1H-2-benzouran-5-yl)oxy]-6-hydroxy-4-methylbenzaldehyde
Manual XrefsDatabases
27023723ChemSpider