CHEBI:210780 - Nemanolone G

ChEBI IDCHEBI:210780
ChEBI NameNemanolone G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O8
Net Charge0
Average Mass386.356
Monoisotopic Mass386.10017
SMILESCC(=O)Cc1cc2c(c(O)c1O)OC1(C)Cc3ccc(=O)c(O)c(O)c3C2O1
InChIInChI=1S/C20H18O8/c1-8(21)5-10-6-11-18-13-9(3-4-12(22)15(24)16(13)25)7-20(2,27-18)28-19(11)17(26)14(10)23/h3-4,6,18,23,26H,5,7H2,1-2H3,(H2,22,24,25)
InChIKeyLKOKSEHVKQBTGK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nemania (ncbitaxon:109374) - DOI (10.1016/j.tet.2017.05.030)
ChEBI Ontology
Outgoing Relation(s)
Nemanolone G (CHEBI:210780) is a cyclic ketone (CHEBI:3992)
IUPAC Name 
3,4,13,14-tetrahydroxy-10-methyl-15-(2-oxopropyl)-11,18-dioxatetracyclo[8.7.1.02,8.012,17]octadeca-2(8),3,6,12(17),13,15-hexaen-5-one
Manual XrefsDatabases
78435248ChemSpider