input word = C00038157

Metabolite InformationStructural formula
Name 13,19-Didesmethylspirolide C
Formula C41H59NO7
Mw 677.42915325
CAS RN 908118-02-5
C_ID C00038157 ,
InChIKey RJNGYXYCHGHJLS-PLRJNAJWNA-N
InChICode InChI=1S/C41H59NO7/c1-24-8-7-9-36-39(22-27(4)28(5)23-42-36)14-13-32(35-20-26(3)38(45)46-35)29(6)33(39)19-25(2)34(43)21-31-12-15-40(47-31)16-17-41(49-40)37(44)11-10-30(18-24)48-41/h19-20,27-28,30-31,33-35,37,43-44H,1,7-18,21-23H2,2-6H3/b25-19-/t27-,28-,30-,31+,33+,34+,35+,37+,39+,40-,41-/m0/s1
SMILES C1C(=C([C@@H]2[C@]3(C1)C(=NC[C@@H]([C@H](C3)C)C)CCCC(=C)C[C@@H]1CC[C@H]([C@@]3(CC[C@]4(CC[C@H](C[C@H](/C(=C\2)/C)O)O4)O3)O1)O)C)[C@@H]1OC(=O)C(=C1)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg
Organism
Kingdom Family Species Reference
--GonyaulacaceaeAlexandrium ostenfeldii Ref.
zoom in