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CHEBI:210444 - 2-bromorugulovasine B

ChEBI IDCHEBI:210444
ChEBI Name2-bromorugulovasine B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H15BrN2O2
Net Charge0
Average Mass347.212
Monoisotopic Mass346.03169
SMILESCN[C@H]1Cc2c(Br)nc3cccc(c23)[C@@]12C=C(C)C(=O)O2
InChIInChI=1S/C16H15BrN2O2/c1-8-7-16(21-15(8)20)10-4-3-5-11-13(10)9(14(17)19-11)6-12(16)18-2/h3-5,7,12,18-19H,6H2,1-2H3/t12-,16-/m0/s1
InChIKeySIFHQNIMYRHRLF-LRDDRELGSA-N
Species of MetaboliteComponentSourceComments
Talaromyces wortmannii (ncbitaxon:28567) - PubMed (26404231)
ChEBI Ontology
Outgoing Relation(s)
2-bromorugulovasine B (CHEBI:210444) is a indoles (CHEBI:24828)
IUPAC Name 
(4S,5S)-2-bromo-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-uran]-2'-one
Manual XrefsDatabases
78441910ChemSpider