input word = C00032411

Metabolite InformationStructural formula
Name Trifoliolasine B
(+)-Trifoliolasine B
Formula C36H51N3O10
Mw 685.35744487
CAS RN 740815-34-3
C_ID C00032411 ,
InChIKey XRSXVXWWMSONJI-QZONZPBGNA-N
InChICode InChI=1S/C36H51N3O10/c1-6-39-16-33(17-49-31(43)19-9-7-8-10-22(19)38-25(40)13-18(2)30(37)42)12-11-24(47-4)35-21-14-20-23(46-3)15-34(44,26(21)27(20)41)36(45,32(35)39)29(48-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,41,44-45H,6,11-17H2,1-5H3,(H2,37,42)(H,38,40)/t18-,20-,21-,23+,24+,26-,27+,28-,29+,32-,33?,34-,35-,36+/m1/s1
SMILES [C@@]12([C@@H]3N(C[C@]4([C@H]([C@@]3([C@@H]3C[C@@H]5[C@H](C[C@]2([C@H]3[C@H]5O)O)OC)[C@H](CC4)OC)[C@@H]1OC)COC(=O)c1c(cccc1)NC(=O)C[C@@H](C)C(=O)N)CC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeDelphinium trifoliatum Ref.
PlantaeRanunculaceaeDelphinium trifoliolatum FINET et GAGNEP Ref.
zoom in