input word = C00039439

Metabolite InformationStructural formula
Name Isoespintanol
Formula C12H18O3
Mw 210.12559444
CAS RN 135626-48-1
C_ID C00039439 ,
InChIKey UTHUIRDJKTWFJW-UHFFFAOYSA-N
InChICode InChI=1S/C12H18O3/c1-7(2)10-9(14-4)6-8(3)12(15-5)11(10)13/h6-7,13H,1-5H3
SMILES COc1cc(C)c(OC)c(O)c1C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeOxandra cf. xylopioides Ref.
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OrganismOxandra cf. xylopioides
ReferenceRojano,J.Nat.Prod.,70,(2007),835