input word = C00040824

Metabolite InformationStructural formula
Name 3-Hydroxythalifaboramine
(+)-3-Hydroxythalifaboramine
Formula C39H44N2O8
Mw 668.3097664
CAS RN 227004-13-9
C_ID C00040824 ,
InChIKey MNKMMHRKOKPHFM-IMDSDXEONA-N
InChICode InChI=1S/C39H44N2O8/c1-40-14-12-22-17-30(44-3)31(45-4)19-25(22)28(40)16-21-8-10-23(11-9-21)49-37-27-18-29-33-24(13-15-41(29)2)35(42)39(48-7)38(47-6)34(33)26(27)20-32(46-5)36(37)43/h8-11,17,19-20,28-29,42-43H,12-16,18H2,1-7H3/t28-,29-/m0/s1
SMILES COc1cc2c(cc1OC)[C@H](Cc1ccc(Oc3c(O)c(OC)cc4c3C[C@H]3c5c(c(O)c(OC)c(OC)c5-4)CCN3C)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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