input word = C00019812

Metabolite InformationStructural formula
Name Chloculol
Formula C15H15ClO4
Mw 294.06588668
CAS RN 131652-35-2
C_ID C00019812 ,
InChIKey HROGOCUMIJWOHN-UHFFFAOYNA-N
InChICode InChI=1S/C15H15ClO4/c1-8(2)14(18)13(16)12-10(19-3)6-4-9-5-7-11(17)20-15(9)12/h4-7,13-14,18H,1H2,2-3H3/t13-,14+/m1/s1
SMILES C=C(C)C(O)C(Cl)c1c(OC)ccc2ccc(=O)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya paniculata Ref.
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OrganismMurraya paniculata
ReferenceIto,J. Chem. Soc. Perkin Trans. I,7,(1990),2047