EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:211954 - Oxepinamide F

ChEBI IDCHEBI:211954
ChEBI NameOxepinamide F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H25N3O4
Net Charge0
Average Mass407.470
Monoisotopic Mass407.18451
SMILESCC[C@H](C)C1=C2N=C3OC=CC=C[C@]3(OC)C(=O)N2[C@@H](Cc2ccccc2)C(=O)N1
InChIInChI=1S/C23H25N3O4/c1-4-15(2)18-19-25-21-23(29-3,12-8-9-13-30-21)22(28)26(19)17(20(27)24-18)14-16-10-6-5-7-11-16/h5-13,15,17H,4,14H2,1-3H3,(H,24,27)/t15-,17-,23+/m0/s1
InChIKeyHFZOLZVOTSSKSM-WSZRMNBISA-N
Species of MetaboliteComponentSourceComments
Aspergillus puniceus (ncbitaxon:41744) - DOI (10.1002/ejoc.201000812)
ChEBI Ontology
Outgoing Relation(s)
Oxepinamide F (CHEBI:211954) has functional parent α-amino acid (CHEBI:33704)
Oxepinamide F (CHEBI:211954) is a organonitrogen compound (CHEBI:35352)
Oxepinamide F (CHEBI:211954) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(7S,10R)-7-benzyl-4-[(2S)-butan-2-yl]-10-methoxy-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1,3,11,13-tetraene-6,9-dione