input word = C00002256

Metabolite InformationStructural formula
Name Protoveratrine A
Formula C41H63NO14
Mw 793.42485573
CAS RN 143-57-7
C_ID C00002256 ,
InChIKey HYTGGNIMZXFORS-MXPIDIRINA-N
InChICode InChI=1S/C41H63NO14/c1-10-20(4)34(46)55-33-28(45)27-23(18-42-17-19(3)12-13-25(42)38(27,9)49)24-16-39-32(40(24,33)50)30(53-22(6)44)29(52-21(5)43)31-36(39,7)15-14-26(41(31,51)56-39)54-35(47)37(8,48)11-2/h19-20,23-33,45,48-51H,10-18H2,1-9H3/t19-,20+,23-,24-,25-,26-,27+,28+,29-,30+,31-,32+,33-,36-,37-,38+,39+,40-,41+/m0/s1
SMILES C1[C@@H]([C@@]2([C@@H]3[C@](C1)([C@@]1([C@@H]([C@@H]([C@@H]3OC(=O)C)OC(=O)C)[C@]3([C@@H](C1)[C@H]1[C@H]([C@H]([C@@H]3OC(=O)[C@@H](CC)C)O)[C@]([C@H]3N(C1)C[C@H](CC3)C)(C)O)O)O2)C)O)OC(=O)[C@](CC)(O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum album Ref.
PlantaeMelanthiaceaeVeratrum nigrum Ref.
PlantaeMelanthiaceaeVeratrum viride Ref.
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OrganismVeratrum nigrum
ReferenceWink, M., Mitt. Julius Kuehn-Inst., 421, (2009), 93-112.