input word = C00042186

Metabolite InformationStructural formula
Name Acetylelatol
Formula C17H24BrClO2
Mw 374.06482062
CAS RN 55196-02-6
C_ID C00042186 ,
InChIKey GQCHYEJJCOTYBA-UHFFFAOYNA-N
InChICode InChI=1S/C17H24BrClO2/c1-10-6-7-17(9-13(10)19)11(2)8-14(21-12(3)20)15(18)16(17,4)5/h14-15H,2,6-9H2,1,3-5H3/t14-,15-,17-/m0/s1
SMILES C=C1CC(OC(C)=O)C(Br)C(C)(C)C12CCC(C)=C(Cl)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia dactylomela Ref.
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