input word = C00024279

Metabolite InformationStructural formula
Name Perakine
(+)-Perakine
Raucaffrine
Formula C21H22N2O3
Mw 350.16304258
CAS RN 4382-56-3
C_ID C00024279 ,
InChIKey GDXJMOGWONJRHL-ZQWJJNTDNA-N
InChICode InChI=1S/C21H22N2O3/c1-10-13(9-24)12-7-16-19-21(14-5-3-4-6-15(14)22-19)8-17(23(10)16)18(12)20(21)26-11(2)25/h3-6,9-10,12-13,16-18,20H,7-8H2,1-2H3/t10-,12-,13-,16-,17-,18-,20+,21+/m0/s1
SMILES CC(=O)O[C@@H]1C2[C@H]3C[C@H]4C5=Nc6ccccc6[C@]51C[C@@H]2N4[C@@H](C)[C@@H]3C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia yunnanensis Ref.
PlantaeApocynaceaeRauvolfia balansae spp.balansae Ref.
PlantaeApocynaceaeRauvolfia biauriculata Ref.
PlantaeApocynaceaeRauvolfia caffra Ref.
PlantaeApocynaceaeRauvolfia perakensis Ref.
PlantaeApocynaceaeRauvolfia sellowii Ref.
PlantaeApocynaceaeRauvolfia serpentina Ref.
PlantaeApocynaceaeRauvolfia sprucei Ref.
PlantaeApocynaceaeRauvolfia sumatrana Ref.
PlantaeApocynaceaeRauvolfia volkensii Ref.
PlantaeApocynaceaeRauvolfia vomitoria Ref.
PlantaeApocynaceaeRauwolfia caffra Ref.
PlantaeApocynaceaeRauwolfia verticillata Ref.
PlantaeApocynaceaeVoacanga africana Ref.
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OrganismRauvolfia volkensii
ReferenceAkinloye,J.Ethnopharmacol.,4,(1981),99