EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:226006 - Epoxykinamycin

ChEBI IDCHEBI:226006
ChEBI NameEpoxykinamycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H14N2O7
Net Charge0
Average Mass394.339
Monoisotopic Mass394.08010
SMILESCC(=O)O[C@@H]1c2c(c3c(=O)c4cccc(O)c4c(=O)c=3c2=[N+]=[N-])[C@H](O)[C@@H]2O[C@]12C
InChIInChI=1S/C20H14N2O7/c1-6(23)28-18-13-11(17(27)19-20(18,2)29-19)10-12(14(13)22-21)16(26)9-7(15(10)25)4-3-5-8(9)24/h3-5,17-19,24,27H,1-2H3/t17-,18+,19-,20+/m0/s1
InChIKeyATRXXFLMCRBZNH-ZGXWSNOMSA-N
Species of MetaboliteComponentSourceComments
Streptomyces chattanoogensis (ncbitaxon:66876) - PubMed (8040072)
ChEBI Ontology
Outgoing Relation(s)
Epoxykinamycin (CHEBI:226006) is a naphthols (CHEBI:25392)
IUPAC Name 
[(3S,4S,6R,7R)-9-diazo-3,13-dihydroxy-6-methyl-11,18-dioxo-5-oxapentacyclo[8.8.0.02,8.04,6.012,17]octadeca-1(10),2(8),12(17),13,15-pentaen-7-yl] acetate
Manual XrefsDatabases
26233556ChemSpider