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CHEBI:202930 - Erabulenol B

ChEBI IDCHEBI:202930
ChEBI NameErabulenol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H30O10
Net Charge0
Average Mass550.560
Monoisotopic Mass550.18390
SMILESCOc1c(O)c2c3c(c1O)C(=O)C1(O)C(=C3C(C)=C(Cc3c(O)c(C)cc(C(C)=O)c3O)C2=O)OC(C)C1(C)C
InChIInChI=1S/C30H30O10/c1-10-8-15(12(3)31)22(33)16(21(10)32)9-14-11(2)17-18-19(23(14)34)24(35)26(39-7)25(36)20(18)27(37)30(38)28(17)40-13(4)29(30,5)6/h8,13,32-33,35-36,38H,9H2,1-7H3
InChIKeyRRMVDSDCIMVCIP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (9727387)
ChEBI Ontology
Outgoing Relation(s)
Erabulenol B (CHEBI:202930) is a naphthofuran (CHEBI:39270)
IUPAC Name 
2-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-4,6,7a-trihydroxy-5-methoxy-1,8,8,9-tetramethyl-9H-phenaleno[1,2-b]uran-3,7-dione
Manual XrefsDatabases
19093953ChemSpider