CHEBI:202424 - Naphthyridinomycin

ChEBI IDCHEBI:202424
ChEBI NameNaphthyridinomycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H27N3O6
Net Charge0
Average Mass417.462
Monoisotopic Mass417.18999
SMILESCOC1=C(C)C(=O)C2=C(C1=O)[C@@H](CO)N1C3C4C(CC([C@H]1O)N4C)C1OCCN1C23
InChIInChI=1S/C21H27N3O6/c1-8-17(26)13-12(18(27)19(8)29-3)11(7-25)24-16-14-9(6-10(20(24)28)22(14)2)21-23(15(13)16)4-5-30-21/h9-11,14-16,20-21,25,28H,4-7H2,1-3H3/t9?,10?,11-,14?,15?,16?,20-,21?/m1/s1
InChIKeySXDWNOFDSOXRRM-DDMUOLFQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (807549)
ChEBI Ontology
Outgoing Relation(s)
Naphthyridinomycin (CHEBI:202424) is a isoquinolines (CHEBI:24922)
IUPAC Name 
(16S,21R)-21-hydroxy-16-(hydroxymethyl)-13-methoxy-12,20-dimethyl-5-oxa-8,17,20-triazahexacyclo[15.3.1.03,19.04,8.09,18.010,15]henicosa-10(15),12-diene-11,14-dione