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CHEBI:215788 - Elmonin

ChEBI IDCHEBI:215788
ChEBI NameElmonin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H16O4
Net Charge0
Average Mass320.344
Monoisotopic Mass320.10486
SMILESCOc1cccc2c1CO[C@@]21Oc2cc(C)cc3ccc(O)c1c23
InChIInChI=1S/C20H16O4/c1-11-8-12-6-7-15(21)19-18(12)17(9-11)24-20(19)14-4-3-5-16(22-2)13(14)10-23-20/h3-9,21H,10H2,1-2H3/t20-/m1/s1
InChIKeyXEOIJMSRWFEZRQ-HXUWFJFHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tetlet.2015.09.116)
ChEBI Ontology
Outgoing Relation(s)
Elmonin (CHEBI:215788) is a naphthols (CHEBI:25392)
IUPAC Name 
(3R)-7-methoxy-10'-methylspiro[1H-2-benzouran-3,3'-2-oxatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene]-5'-ol
Manual XrefsDatabases
78438621ChemSpider