Table 4.
Metabolite | CAS/KEGG | Formula | Mass Difference (ppm) | Overall Score |
Confirmed by MSC |
---|---|---|---|---|---|
Ankorine | 13849-54-2 | C19 H29 N O4 | −2.56 | 99.94 | YES |
Deoxytubulosine | C11817 | C29 H37 N3 O2 | −0.69 | 98.97 | YES |
Ipecac (Cephaeline) | 483-17-0 | C28 H38 N2 O4 | −0.28 | 80.06 | YES |
Lacinilene C 7-methyl ether | 56362-72-2 | C16 H20 O3 | −1.84 | 98.95 | YES |
Tubulosine | 2632-29-3 | C29 H37 N3 O3 | 2.86 | 97.31 | YES |