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CHEBI:213985 - Oxepinamide A

ChEBI IDCHEBI:213985
ChEBI NameOxepinamide A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H21N3O5
Net Charge0
Average Mass347.371
Monoisotopic Mass347.14812
SMILESCCC(C)[C@]1(O)NC(=O)[C@@H](C)n2c1nc1c(c2=O)C=C(OC)C=CO1
InChIInChI=1S/C17H21N3O5/c1-5-9(2)17(23)16-18-14-12(8-11(24-4)6-7-25-14)15(22)20(16)10(3)13(21)19-17/h6-10,23H,5H2,1-4H3,(H,19,21)/t9?,10-,17-/m1/s1
InChIKeyLNZVLFKJDOYTAA-VEJWXMCGSA-N
Species of MetaboliteComponentSourceComments
Acremoniumspecies (ncbitaxon:2046025) - PubMed (10840958)
ChEBI Ontology
Outgoing Relation(s)
Oxepinamide A (CHEBI:213985) is a pyrimidone (CHEBI:38337)
IUPAC Name 
(4R,7R)-4-butan-2-yl-4-hydroxy-12-methoxy-7-methyl-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1(10),2,11,13-tetraene-6,9-dione
Manual XrefsDatabases
9966608ChemSpider