input word = C00012259

Metabolite InformationStructural formula
Name Zoapatanolide B
Formula C20H26O6
Mw 362.17293856
CAS RN 84886-37-3
C_ID C00012259 ,
InChIKey ILHXFEFUBORMRT-LCISAFFBNA-N
InChICode InChI=1S/C20H26O6/c1-6-10(2)19(23)26-18-11(3)7-8-14(21)12(4)9-15-16(17(18)22)13(5)20(24)25-15/h6-7,9,14-18,21-22H,5,8H2,1-4H3/b10-6-,11-7+,12-9-/t14-,15+,16-,17+,18+/m1/s1
SMILES [C@H]12[C@@H](OC(=O)C1=C)/C=C(\[C@@H](C/C=C(/[C@@H]([C@H]2O)OC(=O)/C(=C\C)/C)\C)O)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBlainvillea latifolia Ref.
PlantaeAsteraceaeMontanoa tomentosa Ref.
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