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CHEBI:205773 - 5-bromometagenediindole C

Default Structure
ChEBI IDCHEBI:205773
ChEBI Name5-bromometagenediindole C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H11BrN2O3
Net Charge0
Average Mass359.179
Monoisotopic Mass357.99530
SMILESO=C1Nc2ccc(Br)cc2[C@@]1(O)c1cnc2c(O)cccc12
InChIInChI=1S/C16H11BrN2O3/c17-8-4-5-12-10(6-8)16(22,15(21)19-12)11-7-18-14-9(11)2-1-3-13(14)20/h1-7,18,20,22H,(H,19,21)/t16-/m1/s1
InChIKeyCZEYDJOIQBTASB-MRXNPFEDSA-N
ChEBI Ontology
Outgoing Relation(s)
5-bromometagenediindole C (CHEBI:205773) is a hydroxyindoles (CHEBI:84729)
IUPAC Name 
5-bromo-3-hydroxy-3-(7-hydroxy-1H-indol-3-yl)-1H-indol-2-one
Manual XrefsDatabases
58196990ChemSpider