input word = C00029104

Metabolite InformationStructural formula
Name Thalifaramine
Formula C39H44N2O7
Mw 652.31485177
CAS RN 105437-16-9
C_ID C00029104 ,
InChIKey GZMWREWTPLOYPS-REMWNZQGNA-N
InChICode InChI=1S/C39H44N2O7/c1-40-14-12-23-17-32(43-3)31(42)20-26(23)29(40)16-22-8-10-25(11-9-22)48-37-28-19-30-35-24(13-15-41(30)2)18-33(44-4)38(46-6)36(35)27(28)21-34(45-5)39(37)47-7/h8-11,17-18,20-21,29-30,42H,12-16,19H2,1-7H3/t29-,30-/m0/s1
SMILES COc1cc2c(cc1O)[C@H](Cc1ccc(Oc3c4c(cc(OC)c3OC)-c3c(OC)c(OC)cc5c3[C@H](C4)N(C)CC5)cc1)N(C)CC2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeThalictrum faberi Ref.
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