input word = C00040636

Metabolite InformationStructural formula
Name Vincophylline
Formula C21H26N2O3
Mw 354.19434271
CAS RN 958247-23-9
C_ID C00040636 ,
InChIKey XIILJJFJGOTIAO-LZWSPWQCNA-N
InChICode InChI=1S/C21H26N2O3/c1-3-14-8-10-23-11-9-20-15-6-4-5-7-17(15)22-21(20,23)12-16(14)19(20,13-24)18(25)26-2/h3-7,16,22,24H,8-13H2,1-2H3/b14-3+/t16-,19+,20-,21-/m0/s1
SMILES [C@@H]12[C@](CO)(C(=O)OC)[C@]34c5ccccc5N[C@]3(N(CC4)CC/C/1=C\C)C2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeKopsia singapurensis Ref.
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