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CHEBI:226952 - Discoipyrrole B

ChEBI IDCHEBI:226952
ChEBI NameDiscoipyrrole B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H23NO4
Net Charge0
Average Mass425.484
Monoisotopic Mass425.16271
SMILESCC(C)C[C@@]12OC(=O)c3ccccc3N1C(c1ccc(O)cc1)=C(c1ccccc1)C2=O
InChIInChI=1S/C27H23NO4/c1-17(2)16-27-25(30)23(18-8-4-3-5-9-18)24(19-12-14-20(29)15-13-19)28(27)22-11-7-6-10-21(22)26(31)32-27/h3-15,17,29H,16H2,1-2H3/t27-/m0/s1
InChIKeyHASDSWRXUWTCCZ-MHZLTWQESA-N
Species of MetaboliteComponentSourceComments
Shouchella hunanensis (ncbitaxon:766894) - PubMed (23984625)
ChEBI Ontology
Outgoing Relation(s)
Discoipyrrole B (CHEBI:226952) is a stilbenoid (CHEBI:26776)
IUPAC Name 
1-(4-hydroxyphenyl)-3a-(2-methylpropyl)-2-phenylpyrrolo[1,2-a][3,1]benzoxazine-3,5-dione
Manual XrefsDatabases
30771432ChemSpider