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CHEBI:220477 - Rubetaujaponol K

Default Structure
ChEBI IDCHEBI:220477
ChEBI NameRubetaujaponol K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H30O4
Net Charge0
Average Mass322.445
Monoisotopic Mass322.21441
SMILESCCOCCc1c(C)c(O)c2c(c1COCC)C[C@@](C)(CO)C2
InChIInChI=1S/C19H30O4/c1-5-22-8-7-14-13(3)18(21)16-10-19(4,12-20)9-15(16)17(14)11-23-6-2/h20-21H,5-12H2,1-4H3/t19-/m1/s1
InChIKeyONNQZXKALMLUSK-LJQANCHMSA-N
Species of MetaboliteComponentSourceComments
Russula (ncbitaxon:5402) - PubMed (19252327)
ChEBI Ontology
Outgoing Relation(s)
Rubetaujaponol K (CHEBI:220477) is a indanes (CHEBI:46940)
IUPAC Name 
(2R)-6-(2-ethoxyethyl)-7-(ethoxymethyl)-2-(hydroxymethyl)-2,5-dimethyl-1,3-dihydroinden-4-ol
Manual XrefsDatabases
78438739ChemSpider