input word = C00047711

Metabolite InformationStructural formula
Name Alstoyunine E
(-)-Alstoyunine E
Formula C21H22N2O3
Mw 350.16304258
CAS RN 1188932-15-1
C_ID C00047711 ,
InChIKey SYZGOUOZLCZRJD-MYNXQKNONA-N
InChICode InChI=1S/C21H22N2O3/c1-3-12-10-23(25)16-8-13(12)18-17(23)9-21(20(18)26-11(2)24)14-6-4-5-7-15(14)22-19(16)21/h3-7,13,16-18,20H,8-10H2,1-2H3/b12-3-/t13-,16-,17-,18-,20+,21+,23+/m0/s1
SMILES C/C=C1/C[N+]2([O-])[C@H]3CC1C1[C@@H](OC(C)=O)[C@@]4(C[C@@H]12)C3=Nc1ccccc14
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia yunnanensis Ref.
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