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CHEBI:210396 - Ruberpyrrole

Default Structure
ChEBI IDCHEBI:210396
ChEBI NameRuberpyrrole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H15NO6
Net Charge0
Average Mass269.253
Monoisotopic Mass269.08994
SMILESCOC(=O)Cc1c(CCC(=O)O)cnc1C(=O)OC
InChIInChI=1S/C12H15NO6/c1-18-10(16)5-8-7(3-4-9(14)15)6-13-11(8)12(17)19-2/h6,13H,3-5H2,1-2H3,(H,14,15)
InChIKeyHIARXNDFUNZRAY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Monascus ruber (ncbitaxon:89489) - DOI (10.1007/s10600-019-02903-4)
ChEBI Ontology
Outgoing Relation(s)
Ruberpyrrole (CHEBI:210396) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
3-[5-methoxycarbonyl-4-(2-methoxy-2-oxoethyl)-1H-pyrrol-3-yl]propanoic acid