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CHEBI:217447 - Maduralactomycin B

ChEBI IDCHEBI:217447
ChEBI NameMaduralactomycin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H11BrO7
Net Charge0
Average Mass419.183
Monoisotopic Mass417.96881
SMILESCc1cc(O)c2c(c1Br)[C@@H]1Oc3cccc(C(=O)O)c3C(O)=C1OC2=O
InChIInChI=1S/C18H11BrO7/c1-6-5-8(20)11-12(13(6)19)15-16(26-18(11)24)14(21)10-7(17(22)23)3-2-4-9(10)25-15/h2-5,15,20-21H,1H3,(H,22,23)/t15-/m0/s1
InChIKeyDIARVRAAYLMHDN-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Actinomadura rubteroloni (ncbitaxon:1926885) - PubMed (32193935)
ChEBI Ontology
Outgoing Relation(s)
Maduralactomycin B (CHEBI:217447) is a extended flavonoid (CHEBI:71037)
IUPAC Name 
(12aS)-1-bromo-4,7-dihydroxy-2-methyl-5-oxo-12aH-isochromeno[4,3-b]chromene-8-carboxylic acid