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CHEBI:212479 - Epi-deacetylgriseusin B

ChEBI IDCHEBI:212479
ChEBI NameEpi-deacetylgriseusin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O9
Net Charge0
Average Mass404.371
Monoisotopic Mass404.11073
SMILESC[C@@H]1C[C@H](O)[C@@H](O)[C@@]2(O[C@H](CC(=O)O)CC3=C2C(=O)c2c(O)cccc2C3=O)O1
InChIInChI=1S/C20H20O9/c1-8-5-13(22)19(27)20(28-8)16-11(6-9(29-20)7-14(23)24)17(25)10-3-2-4-12(21)15(10)18(16)26/h2-4,8-9,13,19,21-22,27H,5-7H2,1H3,(H,23,24)/t8-,9+,13+,19-,20-/m1/s1
InChIKeyVNNLNRPAIDMNEB-WPPLHGJESA-N
Species of MetaboliteComponentSourceComments
Nocardiopsisspecies (ncbitaxon:310350) - PubMed (17877337)
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)
Epi-deacetylgriseusin B (CHEBI:212479) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name 
2-[(1R,3S,3'R,4'S,6'R)-3',4',9-trihydroxy-6'-methyl-5,10-dioxospiro[3,4-dihydrobenzo[g]isochromene-1,2'-oxane]-3-yl]acetic acid
Manual XrefsDatabases
23289502ChemSpider