input word = C00001675

Metabolite InformationStructural formula
Name Affinine
Formula C20H24N2O2
Mw 324.18377802
CAS RN 2134-82-9
C_ID C00001675 ,
InChIKey PXFBZOLANLWPMH-WFKXGORMNA-N
InChICode InChI=1S/C20H24N2O2/c1-3-12-10-22(2)18-8-15-13-6-4-5-7-17(13)21-20(15)19(24)9-14(12)16(18)11-23/h3-7,14,16,18,21,23H,8-11H2,1-2H3/b12-3-/t14-,16-,18-/m1/s1
SMILES c1cccc2c1c1c([nH]2)C(=O)C[C@H]2[C@H]([C@@H](C1)N(C/C/2=C/C)C)CO
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePeschiera affinis Ref.
PlantaeApocynaceaePeschiera lacta Ref.
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