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CHEBI:227170 - Rubetaujaponol B

ChEBI IDCHEBI:227170
ChEBI NameRubetaujaponol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26O4
Net Charge0
Average Mass294.391
Monoisotopic Mass294.18311
SMILESCC(=O)O[C@@H]1C(C)=C2CC[C@]2(C)[C@H]2C[C@@](C)(CO)C[C@@]12O
InChIInChI=1S/C17H26O4/c1-10-12-5-6-16(12,4)13-7-15(3,9-18)8-17(13,20)14(10)21-11(2)19/h13-14,18,20H,5-9H2,1-4H3/t13-,14-,15-,16+,17+/m1/s1
InChIKeyXEXDYIBIIXCKRI-MTSZKFMLSA-N
Species of MetaboliteComponentSourceComments
Russula japonica (ncbitaxon:258984) - PubMed (16989517)
ChEBI Ontology
Outgoing Relation(s)
Rubetaujaponol B (CHEBI:227170) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(4R,4aS,6R,7aR,7bR)-4a-hydroxy-6-(hydroxymethyl)-3,6,7b-trimethyl-1,2,4,5,7,7a-hexahydrocyclobuta[e]inden-4-yl] acetate
Manual XrefsDatabases
17245165ChemSpider