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CHEBI:211013 - Protuboxepin F

ChEBI IDCHEBI:211013
ChEBI NameProtuboxepin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H21N3O3
Net Charge0
Average Mass375.428
Monoisotopic Mass375.15829
SMILESCC/C(C)=C1\NC(=O)[C@@H](Cc2ccccc2)n2c1nc1c(c2=O)C=CC=CO1
InChIInChI=1S/C22H21N3O3/c1-3-14(2)18-19-24-21-16(11-7-8-12-28-21)22(27)25(19)17(20(26)23-18)13-15-9-5-4-6-10-15/h4-12,17H,3,13H2,1-2H3,(H,23,26)/b18-14-/t17-/m1/s1
InChIKeyFOYOFJQENUFNDY-OLCHLOJWSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1039/c8qo01147h)
ChEBI Ontology
Outgoing Relation(s)
Protuboxepin F (CHEBI:211013) is a pyrimidone (CHEBI:38337)
IUPAC Name 
(4Z,7R)-7-benzyl-4-butan-2-ylidene-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1(10),2,11,13-tetraene-6,9-dione
Manual XrefsDatabases
71360611ChemSpider