CHEBI:223241 - Oxepinamide E

ChEBI IDCHEBI:223241
ChEBI NameOxepinamide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H23N3O4
Net Charge0
Average Mass393.443
Monoisotopic Mass393.16886
SMILESCC[C@H](C)C1=C2N=C3OC=CC=C[C@]3(O)C(=O)N2[C@@H](Cc2ccccc2)C(=O)N1
InChIInChI=1S/C22H23N3O4/c1-3-14(2)17-18-24-20-22(28,11-7-8-12-29-20)21(27)25(18)16(19(26)23-17)13-15-9-5-4-6-10-15/h4-12,14,16,28H,3,13H2,1-2H3,(H,23,26)/t14-,16-,22+/m0/s1
InChIKeyKEGQNQRTFBYGDC-KHJUTWJGSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1002/ejoc.201000812)
ChEBI Ontology
Outgoing Relation(s)
Oxepinamide E (CHEBI:223241) has functional parent α-amino acid (CHEBI:33704)
Oxepinamide E (CHEBI:223241) is a organonitrogen compound (CHEBI:35352)
Oxepinamide E (CHEBI:223241) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(7S,10R)-7-benzyl-4-[(2S)-butan-2-yl]-10-hydroxy-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1,3,11,13-tetraene-6,9-dione