input word = C00051377

Metabolite InformationStructural formula
Name Lythrancepine III
Formula C31H39NO6
Mw 521.27773799
CAS RN 32209-77-1
C_ID C00051377
InChIKey JEJLGHMYBHWNKG-UHFFFAOYNA-N
InChICode InChI=1S/C31H39NO6/c1-19(33)37-25-11-8-21-9-12-30(35-3)27(14-21)28-15-22(10-13-31(28)36-4)29-18-26(38-20(2)34)17-24-7-5-6-23(16-25)32(24)29/h9-10,12-15,23-26,29H,5-8,11,16-18H2,1-4H3
SMILES COc1ccc2cc1-c1cc(ccc1OC)C1CC(OC(C)=O)CC3CCCC(CC(OC(C)=O)CC2)N31
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLythraceaeLythrum salicaria Ref.
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