input word = C00028559

Metabolite InformationStructural formula
Name Malagashanine
Formula C23H30N2O4
Mw 398.22055746
CAS RN 139682-33-0
C_ID C00028559 ,
InChIKey MUNURTJJRWIXFH-RZKVJTBDNA-N
InChICode InChI=1S/C23H30N2O4/c1-13-20(22(27)28-4)15-11-19-23(9-10-24(19)3)17-7-5-6-8-18(17)25(14(2)26)21(23)16(15)12-29-13/h5-8,13,15-16,19-21H,9-12H2,1-4H3/t13-,15+,16-,19-,20+,21+,23-/m1/s1
SMILES O1[C@@H]([C@@H]([C@@H]2[C@@H](C1)[C@H]1[C@@]3([C@@H](C2)N(CC3)C)c2c(N1C(=O)C)cccc2)C(=O)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos myrtoides Gilg.et Buss Ref.
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