input word = C00028854

Metabolite InformationStructural formula
Name Potanidine A
Formula C41H60N2O11
Mw 756.41971077
CAS RN 161068-58-2
C_ID C00028854 ,
InChIKey DGZCKGSTKCCGOW-UHFFFAOYNA-N
InChICode InChI=1S/C41H60N2O11/c1-8-10-17-53-30(44)18-23(3)35(45)42-27-14-12-11-13-24(27)36(46)54-22-38-16-15-29(50-5)40-26-19-25-28(49-4)20-39(47,31(26)32(25)51-6)41(48,34(52-7)33(38)40)37(40)43(9-2)21-38/h11-14,23,25-26,28-29,31-34,37,47-48H,8-10,15-22H2,1-7H3,(H,42,45)/t23-,25+,26+,28-,29-,31+,32+,33-,34-,37+,38+,39+,40+,41-/m1/s1
SMILES N1(C[C@]2([C@@H]3[C@@]4([C@H]1[C@]([C@@H]3OC)([C@]1([C@H]3[C@@H]4C[C@@H]([C@@H](C1)OC)[C@@H]3OC)O)O)[C@@H](CC2)OC)COC(=O)c1ccccc1NC(=O)[C@@H](CC(=O)OCCCC)C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeDelphinium potaninii W.T.Wang Ref.
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