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CHEBI:203223 - Bioxalomycin beta1

ChEBI IDCHEBI:203223
ChEBI NameBioxalomycin beta1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H23N3O5
Net Charge0
Average Mass385.420
Monoisotopic Mass385.16377
SMILESCOC1=C(C)C(=O)C2=C(C1=O)C1COC3[C@@H]4C[C@H]5C(N4)C(C2N2CCOC52)N13
InChIInChI=1S/C20H23N3O5/c1-7-16(24)12-11(17(25)18(7)26-2)10-6-28-20-9-5-8-13(21-9)15(23(10)20)14(12)22-3-4-27-19(8)22/h8-10,13-15,19-21H,3-6H2,1-2H3/t8-,9-,10?,13?,14?,15?,19?,20?/m0/s1
InChIKeySUTMOLYEXFFQAC-LZOVXBFSSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7844035)
ChEBI Ontology
Outgoing Relation(s)
Bioxalomycin beta1 (CHEBI:203223) is a isoquinolines (CHEBI:24922)
IUPAC Name 
(19S,21S)-9-methoxy-10-methyl-4,17-dioxa-2,14,22-triazaheptacyclo[11.10.0.02,6.03,21.07,12.014,18.019,23]tricosa-7(12),9-diene-8,11-dione