input word = C00042762

Metabolite InformationStructural formula
Name Nb-Methylisoajmaline
(+)-Nb-Methylisoajmaline
Formula C21H29N2O2
Mw 341.22290318
CAS RN 857297-89-3
C_ID C00042762 ,
InChIKey WDFQTBHCKDQVES-BAZHBZNWNA-N
InChICode InChI=1S/C21H29N2O2/c1-4-11-12-9-15-18-21(13-7-5-6-8-14(13)22(18)2)10-16(17(12)19(21)24)23(15,3)20(11)25/h5-8,11-12,15-20,24-25H,4,9-10H2,1-3H3/t11-,12+,15+,16+,17+,18+,19-,20+,21-/m1/s1
SMILES [C@]123[C@H]([C@H]4[N@]5([C@@H](C1)[C@H]([C@@H](C4)[C@H]([C@@H]5O)CC)[C@H]3O)C)N(c1c2cccc1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeRauwolfia serpentina Ref.
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