EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:219317 - Pontemazine A

ChEBI IDCHEBI:219317
ChEBI NamePontemazine A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H19N5O3
Net Charge0
Average Mass401.426
Monoisotopic Mass401.14879
SMILESCOc1ccc(CNc2ccccc2C(N)=O)c2nc3cccc(C(N)=O)c3nc12
InChIInChI=1S/C22H19N5O3/c1-30-17-10-9-12(11-25-15-7-3-2-5-13(15)21(23)28)18-20(17)27-19-14(22(24)29)6-4-8-16(19)26-18/h2-10,25H,11H2,1H3,(H2,23,28)(H2,24,29)
InChIKeyGEFDDKNOOFDCEX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies UT1123 (ncbitaxon:1699875) - PubMed (26483134)
ChEBI Ontology
Outgoing Relation(s)
Pontemazine A (CHEBI:219317) is a phenazines (CHEBI:39201)
IUPAC Name 
6-[(2-carbamoylanilino)methyl]-9-methoxyphenazine-1-carboxamide
Manual XrefsDatabases
58933473ChemSpider