input word = C00025183

Metabolite InformationStructural formula
Name Isoreserpiline
Neoreserpiline
Formula C23H28N2O5
Mw 412.19982202
CAS RN 572-67-8
C_ID C00025183 ,
InChIKey FGWJRZQNNZVCHR-FDIRSQCANA-N
InChICode InChI=1S/C23H28N2O5/c1-12-16-10-25-6-5-13-15-8-20(27-2)21(28-3)9-18(15)24-22(13)19(25)7-14(16)17(11-30-12)23(26)29-4/h8-9,11-12,14,16,19,24H,5-7,10H2,1-4H3/t12-,14-,16-,19-/m0/s1
SMILES c1(c(cc2c(c1)c1c([nH]2)[C@H]2N(CC1)C[C@@H]1[C@H](C2)C(=CO[C@H]1C)C(=O)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAspidosperma discolor Ref.
PlantaeApocynaceaeOchrosia acuminata Ref.
PlantaeApocynaceaeRauwolfia cambodiana pierre ex Pitard Ref.
PlantaeApocynaceaeTabernaemontana coffeoides Boj. Ref.
PlantaeApocynaceaeVinca erecta Rgl.et Schmalh. Ref.
--Neisosperma kilneri Ref.
zoom in