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CHEBI:226701 - Pseudocyphellarin B

Default Structure
ChEBI IDCHEBI:226701
ChEBI NamePseudocyphellarin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O8
Net Charge0
Average Mass404.415
Monoisotopic Mass404.14712
SMILESCOC(=O)c1c(C)c(C)c(OC(=O)c2c(C)c(C)c(O)c(CO)c2O)c(C)c1O
InChIInChI=1S/C21H24O8/c1-8-10(3)16(23)13(7-22)18(25)15(8)21(27)29-19-11(4)9(2)14(20(26)28-6)17(24)12(19)5/h22-25H,7H2,1-6H3
InChIKeySEYDJFVJGHBZJQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies (ncbitaxon:5081) - DOI (10.1016/s0031-9422(00)80346-5)
ChEBI Ontology
Outgoing Relation(s)
Pseudocyphellarin B (CHEBI:226701) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(3-hydroxy-4-methoxycarbonyl-2,5,6-trimethylphenyl) 2,4-dihydroxy-3-(hydroxymethyl)-5,6-dimethylbenzoate
Manual XrefsDatabases
10241556ChemSpider