input word = C00011611

Metabolite InformationStructural formula
Name 3-O-Methylsenecioodontol
Formula C21H28O5
Mw 360.193674
CAS RN 69905-06-2
C_ID C00011611 ,
InChIKey HIZMMBGCMAJVLY-JYRVWZFONA-N
InChICode InChI=1S/C21H28O5/c1-8-13(4)21(24)26-18(10-9-12(2)3)14(5)16-11-17(22)15(6)20(25-7)19(16)23/h8-9,11,18,22-23H,5,10H2,1-4,6-7H3/b13-8-/t18-/m0/s1
SMILES c1(cc(c(c(c1C)OC)O)C(=C)[C@H](CC=C(C)C)OC(=O)/C(=C\C)/C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio oxyodontus Ref.
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