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CHEBI:215595 - 7-bromofolipastatin

Default Structure
ChEBI IDCHEBI:215595
ChEBI Name7-bromofolipastatin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H23BrO5
Net Charge0
Average Mass459.336
Monoisotopic Mass458.07289
SMILESCC=C(C)c1cc(O)c(C)c2c1C(=O)Oc1c(C)c(O)c(Br)c(C(C)=CC)c1O2
InChIInChI=1S/C23H23BrO5/c1-7-10(3)14-9-15(25)12(5)20-17(14)23(27)29-21-13(6)19(26)18(24)16(11(4)8-2)22(21)28-20/h7-9,25-26H,1-6H3
InChIKeySDIMBEOANCTSHN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus unguis (ncbitaxon:40381) - PubMed (29634062)
ChEBI Ontology
Outgoing Relation(s)
7-bromofolipastatin (CHEBI:215595) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
2-bromo-1,7-bis(but-2-en-2-yl)-3,9-dihydroxy-4,10-dimethylbenzo[b][1,4]benzodioxepin-6-one