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CHEBI:203022 - Prodigiosin R1

ChEBI IDCHEBI:203022
ChEBI NameProdigiosin R1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H37N3O
Net Charge0
Average Mass419.613
Monoisotopic Mass419.29366
SMILESCOC1=CC(c2cccn2)=NC1=Cc1nc2cc1[C@@H](CC(C)C)CCCCCCCC2
InChIInChI=1S/C27H37N3O/c1-19(2)15-20-11-8-6-4-5-7-9-12-21-16-22(20)24(29-21)17-26-27(31-3)18-25(30-26)23-13-10-14-28-23/h10,13-14,16-20,28-29H,4-9,11-12,15H2,1-3H3/t20-/m1/s1
InChIKeyFMYDORNOPXGCEO-HXUWFJFHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces griseoviridis (ncbitaxon:45398) - PubMed (18553921)
ChEBI Ontology
Outgoing Relation(s)
Prodigiosin R1 (CHEBI:203022) is a dipyrrins (CHEBI:36749)
IUPAC Name 
13-[[3-methoxy-5-(1H-pyrrol-2-yl)pyrrol-2-ylidene]methyl]-2-(2-methylpropyl)-12-azabicyclo[9.2.1]tetradeca-1(13),11(14)-diene
Manual XrefsDatabases
78434749ChemSpider