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CHEBI:216766 - 18-oxonapyradiomycin A1

ChEBI IDCHEBI:216766
ChEBI Name18-oxonapyradiomycin A1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28Cl2O6
Net Charge0
Average Mass495.399
Monoisotopic Mass494.12629
SMILESCC(C=O)=CCCC(C)=CC[C@@]12OC(C)(C)[C@H](Cl)C[C@]1(Cl)C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C25H28Cl2O6/c1-14(6-5-7-15(2)13-28)8-9-25-21(31)17-10-16(29)11-18(30)20(17)22(32)24(25,27)12-19(26)23(3,4)33-25/h7-8,10-11,13,19,29-30H,5-6,9,12H2,1-4H3/t19-,24+,25+/m1/s1
InChIKeyFPOOHFGLFKYUON-NGXZDTIWSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (18271555)
ChEBI Ontology
Outgoing Relation(s)
18-oxonapyradiomycin A1 (CHEBI:216766) is a menaquinones (CHEBI:25185)
IUPAC Name 
8-[(3R,4aR,10aS)-3,4a-dichloro-6,8-dihydroxy-2,2-dimethyl-5,10-dioxo-3,4-dihydrobenzo[g]chromen-10a-yl]-2,6-dimethylocta-2,6-dienal