input word = C00027146

Metabolite InformationStructural formula
Name Isothaliphine
(-)-Isothaliphine
Formula C41H44N2O11
Mw 740.29451026
CAS RN 790227-73-5
C_ID C00027146 ,
InChIKey YRJXNTYZVFUKPV-UHFFFAOYNA-N
InChICode InChI=1S/C41H44N2O11/c1-43-12-11-21-23(15-31(47-4)41(51-8)38(21)49-6)25(43)13-20-14-29(45-2)30(46-3)17-28(20)54-32-16-24-26(44)18-42-36-33(24)35(39(32)50-7)34-22(37(36)48-5)9-10-27-40(34)53-19-52-27/h9-10,14-17,25-26,42,44H,11-13,18-19H2,1-8H3/t25-,26-/m0/s1
SMILES COc1cc(CC2c3cc(OC)c(OC)c(OC)c3CCN2C)c(Oc2cc3c4c(c(OC)c5ccc6c(c5c4c2OC)OCO6)NCC3O)cc1OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeIsopyrum thalictroides Ref.
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