input word = C00020529

Metabolite InformationStructural formula
Name 3-Chloro-8beta-(5-acetoxy-tiglinoyloxy)-dehydroleucodin
Formula C22H23ClO7
Mw 434.1132308
CAS RN 80388-14-3
C_ID C00020529 ,
InChIKey QEJGDCYPSZBZMO-QLKDUKSHNA-N
InChICode InChI=1S/C22H23ClO7/c1-6-13(8-28-12(5)24)22(27)29-14-7-9(2)15-17(10(3)18(23)19(15)25)20-16(14)11(4)21(26)30-20/h6,14,16-17,20H,4,7-8H2,1-3,5H3/b13-6+/t14-,16-,17+,20-/m1/s1
SMILES C=C1C(=O)O[C@@H]2[C@H]3C(C)=C(Cl)C(=O)C3=C(C)C[C@@H](OC(=O)/C(=C/C)COC(C)=O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLasiolaena santosii Ref.
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