input word = C00025767

Metabolite InformationStructural formula
Name Alstovenine
(+)-Isovenenatine
3-Isovenenatine
Isovenenatine
Formula C22H28N2O4
Mw 384.2049074
CAS RN 4837-79-0
C_ID C00025767 ,
InChIKey WMMZYEBFJWWUJX-OSOWDQOSNA-N
InChICode InChI=1S/C22H28N2O4/c1-27-18-5-3-4-15-19(18)13-8-9-24-11-12-6-7-17(25)20(22(26)28-2)14(12)10-16(24)21(13)23-15/h3-5,12,14,16-17,20,23,25H,6-11H2,1-2H3/t12-,14-,16+,17-,20+/m1/s1
SMILES COC(=O)[C@H]1[C@H]2C[C@H]3c4[nH]c5cccc(OC)c5c4CCN3C[C@H]2CC[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia venenata R.Br Ref.
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