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CHEBI:226098 - Pyonitrin D

ChEBI IDCHEBI:226098
ChEBI NamePyonitrin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H11Cl2N3OS
Net Charge0
Average Mass412.301
Monoisotopic Mass410.99999
SMILESOc1ccccc1-c1nc(-c2nc3c(Cl)cccc3c3c(Cl)cnc23)cs1
InChIInChI=1S/C20H11Cl2N3OS/c21-12-6-3-5-11-16-13(22)8-23-19(16)18(25-17(11)12)14-9-27-20(24-14)10-4-1-2-7-15(10)26/h1-9,23,26H
InChIKeySUEYFBRHOFKAFG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas protegens (ncbitaxon:380021) - PubMed (31600443)
ChEBI Ontology
Outgoing Relation(s)
Pyonitrin D (CHEBI:226098) is a pyrroloquinoline (CHEBI:50918)
IUPAC Name 
2-[4-(1,6-dichloro-3H-pyrrolo[2,3-c]quinolin-4-yl)-1,3-thiazol-2-yl]phenol