input word = C00008326

Metabolite InformationStructural formula
Name Diplacone
Formula C25H28O6
Mw 424.18858863
CAS RN 73676-38-7
C_ID C00008326 ,
InChIKey XCYSQFHYFNWYFP-VIZOYTHANA-N
InChICode InChI=1S/C25H28O6/c1-14(2)5-4-6-15(3)7-9-17-19(27)12-23-24(25(17)30)21(29)13-22(31-23)16-8-10-18(26)20(28)11-16/h5,7-8,10-12,22,26-28,30H,4,6,9,13H2,1-3H3/b15-7+/t22-/m0/s1
SMILES c1(c(c(c2c(c1)O[C@@H](CC2=O)c1ccc(c(c1)O)O)O)C/C=C(/CCC=C(C)C)\C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMacaranga alnifolia Ref.
PlantaeHernandiaceaeHernandia nymphaeifolia Ref.
PlantaePaulowniaceaePaulownia tomentosa Ref.
PlantaePhrymaceaeDiplacus aurantiacus Ref.
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