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CHEBI:198286 - Erabulenol A

ChEBI IDCHEBI:198286
ChEBI NameErabulenol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O6
Net Charge0
Average Mass356.374
Monoisotopic Mass356.12599
SMILESCOC1=C(O)c2c(O)c3c(c4c(C)cc(O)c(c24)C1=O)O[C@@H](C)C3(C)C
InChIInChI=1S/C20H20O6/c1-7-6-9(21)11-12-10(7)18-14(20(3,4)8(2)26-18)15(22)13(12)17(24)19(25-5)16(11)23/h6,8,21-22,24H,1-5H3/t8-/m0/s1
InChIKeyXXKJBDTZZBQBCP-QMMMGPOBSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (9727387)
ChEBI Ontology
Outgoing Relation(s)
Erabulenol A (CHEBI:198286) is a ortho- and peri-fused tricyclic hydrocarbon (CHEBI:51120)
IUPAC Name 
(9S)-3,6,7-trihydroxy-5-methoxy-1,8,8,9-tetramethyl-9H-phenaleno[1,2-b]uran-4-one
Manual XrefsDatabases
64854464ChemSpider