input word = C00043259

Metabolite InformationStructural formula
Name Akuammiginone
Formula C21H22N2O4
Mw 366.15795721
CAS RN 761445-62-9
C_ID C00043259 ,
InChIKey ZMYDUZQSVNRXQW-KNEFILLVNA-N
InChICode InChI=1S/C21H23N2O4/c1-3-12-10-23(2)9-8-20-13-6-4-5-7-14(13)22-21(20)17(23)16(24)15(12)19(20,11-27-21)18(25)26/h3-7,15,17,22H,8-11H2,1-2H3,(H,25,26)/b12-3-/t15-,17+,19+,20+,21-/m1/s1
SMILES [C@H]12[C@@]3(C(=O)O)[C@]45[C@]([C@H](C1=O)[N@@](C/C/2=C/C)(CC4)C)(Nc1c5cccc1)OC3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia scholaris Ref.
zoom in