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CHEBI:203895 - Rubetaujaponol E

Default Structure
ChEBI IDCHEBI:203895
ChEBI NameRubetaujaponol E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCc1c(CCO)c(CO)cc2c1C[C@@](C)(CO)C2
InChIInChI=1S/C15H22O3/c1-10-13(3-4-16)12(8-17)5-11-6-15(2,9-18)7-14(10)11/h5,16-18H,3-4,6-9H2,1-2H3/t15-/m0/s1
InChIKeyQUWDEGPAZJPJGB-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Russula japonica (ncbitaxon:258984) - PubMed (16989517)
ChEBI Ontology
Outgoing Relation(s)
Rubetaujaponol E (CHEBI:203895) is a indanes (CHEBI:46940)
IUPAC Name 
2-[(2S)-2,6-bis(hydroxymethyl)-2,4-dimethyl-1,3-dihydroinden-5-yl]ethanol
Manual XrefsDatabases
17245166ChemSpider