EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:223940 - Oxepinamide H

ChEBI IDCHEBI:223940
ChEBI NameOxepinamide H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H19N3O4
Net Charge0
Average Mass365.389
Monoisotopic Mass365.13756
SMILESCO[C@]1(Cc2ccccc2)NC(=O)[C@@H](C)n2c1nc1c(c2=O)C=CC=CO1
InChIInChI=1S/C20H19N3O4/c1-13-16(24)22-20(26-2,12-14-8-4-3-5-9-14)19-21-17-15(18(25)23(13)19)10-6-7-11-27-17/h3-11,13H,12H2,1-2H3,(H,22,24)/t13-,20+/m1/s1
InChIKeySVHXOGSMWVXKRF-XCLFUZPHSA-N
Species of MetaboliteComponentSourceComments
Aspergillus puniceus (ncbitaxon:41744) - PubMed (31095389)
ChEBI Ontology
Outgoing Relation(s)
Oxepinamide H (CHEBI:223940) is a pyrimidone (CHEBI:38337)
IUPAC Name 
(4S,7R)-4-benzyl-4-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
76712514ChemSpider