input word = C00051378

Metabolite InformationStructural formula
Name Lythrancine I
Formula C27H35NO5
Mw 453.25152324
CAS RN 32209-71-5
C_ID C00051378
InChIKey NHAMBFHTELHJSW-UHFFFAOYNA-N
InChICode InChI=1S/C27H35NO5/c1-32-25-10-7-16-6-9-19(29)14-18-4-3-5-22-27(31)24(30)15-23(28(18)22)17-8-11-26(33-2)21(13-17)20(25)12-16/h7-8,10-13,18-19,22-24,27,29-31H,3-6,9,14-15H2,1-2H3
SMILES COc1ccc2cc1-c1cc(ccc1OC)C1CC(O)C(O)C3CCCC(CC(O)CC2)N13
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLythraceaeLythrum salicaria Ref.
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