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CHEBI:202843 - Cycloprodigiosin

ChEBI IDCHEBI:202843
ChEBI NameCycloprodigiosin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H23N3O
Net Charge0
Average Mass321.424
Monoisotopic Mass321.18411
SMILESCOC1=CC(c2cccn2)=N/C1=C\c1nc(C)c2c1[C@@H](C)CCC2
InChIInChI=1S/C20H23N3O/c1-12-6-4-7-14-13(2)22-18(20(12)14)10-17-19(24-3)11-16(23-17)15-8-5-9-21-15/h5,8-12,21-22H,4,6-7H2,1-3H3/b17-10-/t12-/m0/s1
InChIKeyDSHIIBUGOWQFSO-NJPLLEPOSA-N
Species of MetaboliteComponentSourceComments
Vibrio gazogenes (ncbitaxon:687) - DOI (10.1016/s0040-4039(00)88026-0)
ChEBI Ontology
Outgoing Relation(s)
Cycloprodigiosin (CHEBI:202843) is a dipyrrins (CHEBI:36749)
IUPAC Name 
3-[(Z)-[3-methoxy-5-(1H-pyrrol-2-yl)pyrrol-2-ylidene]methyl]-1,4-dimethyl-4,5,6,7-tetrahydro-2H-isoindole
Manual XrefsDatabases
10278440ChemSpider