input word = C00023261

Metabolite InformationStructural formula
Name 9beta-Acetoxyatripliciolide-8-O-methacrylate
Formula C21H22O8
Mw 402.13146768
CAS RN 79694-68-1
C_ID C00023261 ,
InChIKey ZGWLGOOKDGKGSZ-RDSRWRCONA-N
InChICode InChI=1S/C21H22O8/c1-9(2)19(24)28-17-16-11(4)20(25)27-14(16)7-10(3)13-8-15(23)21(6,29-13)18(17)26-12(5)22/h7-8,14,16-18H,1,4H2,2-3,5-6H3/b10-7-/t14-,16+,17+,18+,21+/m1/s1
SMILES [C@H]12OC(=O)C(=C)[C@@H]1[C@@H]([C@@H]([C@@]1(C(=O)C=C(/C(=C\2)/C)O1)C)OC(=O)C)OC(=O)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTrichogonia prancii Ref.
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