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CHEBI:200036 - (2S,10R,3'S,4'S,6'S)-4'-deacetyl-griseusin B

ChEBI IDCHEBI:200036
ChEBI Name(2S,10R,3'S,4'S,6'S)-4'-deacetyl-griseusin 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-/m0/s1
InChIKeyVNNLNRPAIDMNEB-CIPJCBEKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (21934691)
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)
(2S,10R,3'S,4'S,6'S)-4'-deacetyl-griseusin B (CHEBI:200036) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name 
2-[(1S,3R,3'S,4'S,6'S)-3',4',9-trihydroxy-6'-methyl-5,10-dioxospiro[3,4-dihydrobenzo[g]isochromene-1,2'-oxane]-3-yl]acetic acid
Manual XrefsDatabases
58826674ChemSpider