input word = C00029105

Metabolite InformationStructural formula
Name Thalifarazine
Formula C40H46N2O8
Mw 682.32541646
CAS RN 105418-68-6
C_ID C00029105 ,
InChIKey PBTNCWJDTMEHKY-REMWNZQGNA-N
InChICode InChI=1S/C40H46N2O8/c1-41-15-13-23-18-31(43)32(44-3)20-26(23)29(41)17-22-9-11-24(12-10-22)50-37-28-19-30-34-25(14-16-42(30)2)36(46-5)40(49-8)39(48-7)35(34)27(28)21-33(45-4)38(37)47-6/h9-12,18,20-21,29-30,43H,13-17,19H2,1-8H3/t29-,30-/m0/s1
SMILES c12c(C[C@H]3c4c1c(c(c(c4CCN3C)OC)OC)OC)c(c(c(c2)OC)OC)Oc1ccc(cc1)C[C@@H]1N(CCc2c1cc(c(c2)O)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeThalictrum faberi Ref.
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OrganismThalictrum faberi
ReferenceLin,J.Nat.Prod.,57,(1994),1430