input word = C00040840

Metabolite InformationStructural formula
Name 5'-Hydroxythalifaboramine
(+)-5'-Hydroxythalifaboramine
Formula C39H44N2O8
Mw 668.3097664
CAS RN 227004-25-3
C_ID C00040840 ,
InChIKey OCQIGPWTTUGDSS-IMDSDXEONA-N
InChICode InChI=1S/C39H44N2O8/c1-40-15-13-24-25(19-32(46-5)39(48-7)35(24)42)28(40)16-21-8-10-23(11-9-21)49-37-27-18-29-33-22(12-14-41(29)2)17-31(45-4)38(47-6)34(33)26(27)20-30(44-3)36(37)43/h8-11,17,19-20,28-29,42-43H,12-16,18H2,1-7H3/t28-,29-/m0/s1
SMILES c12c(C[C@H]3c4c1c(c(cc4CCN3C)OC)OC)c(c(c(c2)OC)O)Oc1ccc(cc1)C[C@H]1c2c(CCN1C)c(c(c(c2)OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeThalictrum faberi Ref.
zoom in