input word = C00029393

Metabolite InformationStructural formula
Name 14-Acetoxygelsenicine
Formula C21H24N2O5
Mw 384.16852189
CAS RN 881184-27-6
C_ID C00029393 ,
InChIKey MLBPCDDHLQCMGP-ZWEYKVSPNA-N
InChICode InChI=1S/C21H24N2O5/c1-4-14-17-12-10-27-19(18(17)28-11(2)24)21(9-15(12)22-14)13-7-5-6-8-16(13)23(26-3)20(21)25/h5-8,12,15,17-19H,4,9-10H2,1-3H3/t12-,15+,17-,18-,19-,21-/m1/s1
SMILES C(=O)(O[C@@H]1[C@@H]2[C@@H]3CO[C@H]1[C@@]1(C[C@@H]3N=C2CC)c2c(N(C1=O)OC)cccc2)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeGelsemiaceaeGelsemium elegans Ref.
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