input word = C00029112

Metabolite InformationStructural formula
Name Thalisopidine
Formula C37H40N2O7
Mw 624.28355165
CAS RN 26989-49-1
C_ID C00029112 ,
InChIKey AFIKQDOXLXLVDZ-LEFKRGDZNA-N
InChICode InChI=1S/C37H40N2O7/c1-38-14-12-23-19-31(42-3)32-20-26(23)27(38)17-22-8-11-29(40)30(18-22)45-24-9-6-21(7-10-24)16-28-33-25(13-15-39(28)2)34(41)36(43-4)37(44-5)35(33)46-32/h6-11,18-20,27-28,40-41H,12-17H2,1-5H3/t27-,28-/m0/s1
SMILES c12ccc(cc1)Oc1c(ccc(c1)C[C@@H]1N(CCc3c1cc(c(c3)OC)Oc1c3[C@H](C2)N(CCc3c(c(c1OC)OC)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeThalictrum fargestii Ref.
PlantaeRanunculaceaeThalictrum isopyroides Ref.
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