input word = C00051386

Metabolite InformationStructural formula
Name Lythranine
Formula C28H37NO5
Mw 467.2671733
CAS RN 32420-54-5
C_ID C00051386
InChIKey SMIBAIAOXOZBGB-CUHYEOKBNA-N
InChICode InChI=1S/C28H37NO5/c1-18(30)34-24-11-7-20-9-13-28(33-2)26(15-20)25-14-19(8-12-27(25)32)6-10-23(31)16-21-4-3-5-22(17-24)29-21/h8-9,12-15,21-24,29,31-32H,3-7,10-11,16-17H2,1-2H3
SMILES COc1ccc2cc1-c1cc(ccc1O)CCC(O)C[C@H]1CCC[C@H](CC(OC(C)=O)CC2)N1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLythraceaeLythrum salicaria Ref.
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