input word = C00045937

Metabolite InformationStructural formula
Name Ferupennin F
(+)-Ferupennin F
Formula C22H26O9
Mw 434.15768243
CAS RN 486437-94-9
C_ID C00045937 ,
InChIKey DZMQOTRZCJPNSY-PXNQTHKWNA-N
InChICode InChI=1S/C22H26O9/c1-9-7-13(25)15-10(2)8-14(29-19(26)21(5,28)11(3)23)17-18(16(9)15)30-20(27)22(17,6)31-12(4)24/h7,14,16-18,28H,8H2,1-6H3/t14-,16+,17+,18-,21+,22-/m0/s1
SMILES CC(=O)O[C@]1(C)C(=O)O[C@H]2[C@@H]3C(C)=CC(=O)C3=C(C)C[C@H](OC(=O)C(C)(O)C(C)=O)[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula penninervis Ref.
zoom in