input word = C00020694

Metabolite InformationStructural formula
Name Zoapatanolide C
Formula C22H26O9
Mw 434.15768243
CAS RN 90734-99-9
C_ID C00020694 ,
InChIKey WGZVUXQFHASBJA-NLYOGGAWNA-N
InChICode InChI=1S/C22H26O9/c1-7-8(2)19(25)29-15-10(4)13-16(28-11(5)23)18-21(6,31-18)22(13,27)17-12(14(15)24)9(3)20(26)30-17/h7,12,14-18,24,27H,3H2,1-2,4-6H3/b8-7-/t12-,14-,15-,16+,17+,18-,21-,22-/m1/s1
SMILES [C@@]12(C(=C([C@H]([C@@H]([C@@H]3[C@@H]1OC(=O)C3=C)O)OC(=O)/C(=C\C)/C)C)[C@@H]([C@@H]1[C@]2(O1)C)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMontanoa tomentosa Ref.
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