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. 2020 Dec 22;10(1):1. doi: 10.3390/cells10010001

Table 4.

Compounds found in Alangium species identified by Agilent MSC Software.

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