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CHEBI:228922 - (-)-Eudesm-3-ene-6alpha-acetoxy-7alpha-ol

ChEBI IDCHEBI:228922
ChEBI Name(-)-Eudesm-3-ene-6alpha-acetoxy-7alpha-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H28O3
Net Charge0
Average Mass280.408
Monoisotopic Mass280.20384
SMILESCC(=O)O[C@@H]1C2C(C)=CCC[C@]2(C)CC[C@@]1(O)C(C)C
InChIInChI=1S/C17H28O3/c1-11(2)17(19)10-9-16(5)8-6-7-12(3)14(16)15(17)20-13(4)18/h7,11,14-15,19H,6,8-10H2,1-5H3/t14?,15-,16-,17-/m1/s1
InChIKeyHXQJVMJSHJANLJ-XMMHPARDSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
(-)-Eudesm-3-ene-6alpha-acetoxy-7alpha-ol (CHEBI:228922) is a eudesmane sesquiterpenoid (CHEBI:62508)
IUPAC Name 
[(1R,2R,4aR)-2-hydroxy-4a,8-dimethyl-2-propan-2-yl-1,3,4,5,6,8a-hexahydronaphthalen-1-yl] acetate
Manual XrefsDatabases
4476155ChemSpider