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CHEBI:213900 - Ent-astropaquinone C

ChEBI IDCHEBI:213900
ChEBI NameEnt-astropaquinone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O6
Net Charge0
Average Mass304.298
Monoisotopic Mass304.09469
SMILESCOc1cc(OC)c2c(c1)C(=O)C1=C(C2=O)[C@@H](O)O[C@H](C)C1
InChIInChI=1S/C16H16O6/c1-7-4-9-13(16(19)22-7)15(18)12-10(14(9)17)5-8(20-2)6-11(12)21-3/h5-7,16,19H,4H2,1-3H3/t7-,16+/m1/s1
InChIKeyPJDRPXKBIRDAFE-QZTNRIJFSA-N
Species of MetaboliteComponentSourceComments
Torula herbarum (ncbitaxon:646131) - PubMed (23043498)
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
Ent-astropaquinone C (CHEBI:213900) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name 
(1S,3R)-1-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione
Manual XrefsDatabases
29215153ChemSpider