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CHEBI:215742 - Stephacidin A

ChEBI IDCHEBI:215742
ChEBI NameStephacidin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H29N3O3
Net Charge0
Average Mass431.536
Monoisotopic Mass431.22089
SMILESCC1(C)C=Cc2c(ccc3c4c(nc23)C(C)(C)C2CC35CCCN3C(=O)C2(C4)NC5=O)O1
InChIInChI=1S/C26H29N3O3/c1-23(2)10-8-15-17(32-23)7-6-14-16-12-26-18(24(3,4)20(16)27-19(14)15)13-25(21(30)28-26)9-5-11-29(25)22(26)31/h6-8,10,18,27H,5,9,11-13H2,1-4H3,(H,28,30)
InChIKeyYCWBTRJVYADFLQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus ochraceus (ncbitaxon:40380) - PubMed (12465964)
ChEBI Ontology
Outgoing Relation(s)
Stephacidin A (CHEBI:215742) is a pyrroloquinoline (CHEBI:50918)
IUPAC Name 
9,9,16,16-tetramethyl-8-oxa-14,23,25-triazaheptacyclo[17.5.2.01,17.03,15.04,13.07,12.019,23]hexacosa-3(15),4(13),5,7(12),10-pentaene-24,26-dione
Manual XrefsDatabases
8449863ChemSpider