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CHEBI:206862 - Paramagnetoquinone A

ChEBI IDCHEBI:206862
ChEBI NameParamagnetoquinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H13NO8
Net Charge0
Average Mass419.345
Monoisotopic Mass419.06412
SMILESCNc1cc(=O)c2c(O)c3c(=O)c4c5c(c(OC)cc4c(=O)c3cc2c1=O)C(=O)OC5
InChIInChI=1S/C22H13NO8/c1-23-11-5-12(24)15-7(19(11)26)3-8-17(21(15)28)20(27)14-9(18(8)25)4-13(30-2)16-10(14)6-31-22(16)29/h3-5,23,28H,6H2,1-2H3
InChIKeyKXXPVAWMGYJIRL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Actinoallomurusspecies (ncbitaxon:1872127) - PubMed (28218529)
ChEBI Ontology
Outgoing Relation(s)
Paramagnetoquinone A (CHEBI:206862) is a quinone (CHEBI:36141)
Paramagnetoquinone A (CHEBI:206862) is a tetracenes (CHEBI:51270)
IUPAC Name 
21-hydroxy-9-methoxy-17-(methylamino)-6-oxapentacyclo[11.8.0.03,11.04,8.015,20]henicosa-1(13),3,8,10,14,17,20-heptaene-2,7,12,16,19-pentone
Manual XrefsDatabases
78435547ChemSpider